Model name: model_name=MEAM_LAMMPS_EtesamiAsadi_2018_Ni__MO_937008984446_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5200000256299973
cohesive_energy=4.450350014603218
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.9956551935440598e-19, 2.85121751610006e-19, 3.50810993604006e-19, 4.0444225425052197e-19, 4.49606011386348e-19, 4.88341835866566e-19, 5.219522972946179e-19, 5.5133301240891e-19, 5.771360670994799e-19, 5.99853329592966e-19, 6.189288445973699e-19, 6.33186614463336e-19, 6.463132476256979e-19, 6.58698073006518e-19, 6.69937342094028e-19, 6.79760287037082e-19, 6.881236490665619e-19, 6.95117150073972e-19, 7.008337163040839e-19, 7.053614674717679e-19, 7.087741037021879e-19, 7.111405185906059e-19, 7.125199926724798e-19, 7.1296860213e-19, 7.124879491398e-19, 7.109338378048199e-19, 7.081220178121499e-19, 7.038329909629319e-19, 6.97800795935922e-19, 6.89716212640758e-19, 6.792011273918159e-19, 6.658037263783079e-19, 6.489728608381378e-19, 6.2784816191884795e-19, 6.0172947843138e-19, 5.69754839346642e-19, 5.306729447134799e-19, 4.828495743652139e-19, 4.2423394221032397e-19, 3.5223532863163196e-19, 2.63508388817346e-19, 1.53677578380012e-19, 1.6900239788422197e-20, -1.54736617135086e-19, -3.7263904806562195e-19, -6.54626942179524e-19, -1.030278082317066e-18, -1.5517497266214838e-18, -2.3172921528195598e-18, -3.5258780749111196e-18, -5.61423520849842e-18, -9.6314047264593e-18, -1.8362386184610598e-17, -3.99480313215024e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.018103893857276756
Energy: 0.018816348590116
Energy: 0.01842942970774745
Energy: 0.018309753515093268
Energy: 0.5448003960510797
Energy: 0.018469408461328992
Energy: 0.018816348590777528
Energy: 0.15748049602539926
Energy: 0.15741885252353227
Energy: 0.15754970356978742
Energy: 0.15744761372338054
Energy: 0.15736360535578636
Energy: 0.01842942970774745
Energy: 0.15741885252287074
Energy: 0.1574071726439106
Energy: 0.01846804288169077
Energy: 0.1575447174628303
Energy: 0.1585827771484699
Energy: 0.0183097535147625
Energy: 0.15754970356978742
Energy: 0.01846804288169077
Energy: 0.01841497736619635
Energy: 0.15761060957251358
Energy: 0.018468612072023625
Energy: 0.5448003954976374
Energy: 0.157447613722719
Energy: 0.15754471746249954
Energy: 0.1576106095718888
Energy: 0.15815509860783664
Energy: 0.1575991885646445
Energy: 0.018469408462652052
Energy: 0.1573636053554556
Energy: 0.1585827771484699
Energy: 0.018468612072023625
Energy: 0.1575991885646445
Energy: 0.018454992552036274

minimum gb energy = 0.018103893857276756 eV
minimum distance =  2.48646864502734 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.5690387533085501
Energy: 1.144834062950819
Energy: 1.2224216067341926
Energy: 1.4102500462306549
Energy: 1.424331886326562
Energy: 1.2279111579281614
Energy: 1.5991905146414025
Energy: 1.1836018714085637
Energy: 1.1835302763237108
Energy: 1.1282354267177492
Energy: 1.184207453289798
Energy: 1.1745242294553915
Energy: 1.5328130472792831
Energy: 1.1831407408530918
Energy: 1.183446084640371
Energy: 1.1773028392719564
Energy: 1.1834038247464453
Energy: 1.1373583442052118
Energy: 1.688645742905627
Energy: 1.1593064172855572
Energy: 1.156198419329472
Energy: 1.158475714883076
Energy: 1.143751070820775
Energy: 1.1561698096679451
Energy: 1.5233417028439378
Energy: 1.1888475173935515
Energy: 1.1885414224016175
Energy: 1.1766095170855944
Energy: 1.188407536556401
Energy: 1.1745677864955628
Energy: 1.476200609850526
Energy: 1.1808936321574905
Energy: 1.1693258034488556
Energy: 1.1724860260123764
Energy: 1.1892065910819558
Energy: 1.1689620442371467
Energy: 1.46824799409831
Energy: 1.168359118557409
Energy: 1.1684217365516134
Energy: 1.172310686888896
Energy: 1.166960863492256
Energy: 1.1686953153182011
Energy: 1.2159219214850783
Energy: 1.1736824632914473
Energy: 1.1734982541555734
Energy: 1.1317145616774744
Energy: 1.1701496532414932
Energy: 1.1743442042753764
Energy: 1.2148767501393067
Energy: 1.1688022605315311
Energy: 1.1712158043686163
Energy: 1.2119941161015724
Energy: 1.1683146508865552
Energy: 1.1690989178748878
Energy: 1.2157953100966457
Energy: 1.1934597984840936
Energy: 1.1939911769908138
Energy: 1.2123457266283528
Energy: 1.1747928650504889
Energy: 1.150244689337557
Energy: 1.3383931234768973
Energy: 1.1622941221461303
Energy: 1.123450262067663
Energy: 1.2960040067293643
Energy: 1.1251328749985243
Energy: 1.1461863278870859
Energy: 1.1836496699158057
Energy: 1.1270888313081096
Energy: 1.1593278271262621
Energy: 1.1838294357867096
Energy: 1.170733709109755
Energy: 1.1155718535713164
Energy: 1.1834034669493936
Energy: 1.183455673363447
Energy: 1.171834088499819
Energy: 1.1835282229518174
Energy: 1.151057786171376
Energy: 1.0981703384328636
Energy: 1.2378208269888835
Energy: 1.1674189549169265
Energy: 1.1560824529119922
Energy: 1.235992205955242
Energy: 1.1692161170508508
Energy: 1.1422217509741002
Energy: 1.1972345442180774
Energy: 1.19179023529965
Energy: 1.192889546857776
Energy: 1.1990827884189388
Energy: 1.1881026587394798
Energy: 1.1958228012983207
Energy: 1.1990533386347337
Energy: 1.1550813725265952
Energy: 1.155372637948396
Energy: 1.1988103346679775
Energy: 1.138265742401284
Energy: 1.1553962380441978
Energy: 1.3008150466230513
Energy: 1.172329574951876
Energy: 1.1724892780487997
Energy: 1.1790403119918198
Energy: 1.1737648550484978
Energy: 1.162982167647391
Energy: 1.299931262884461
Energy: 1.1754890194362797
Energy: 1.1753887260154388
Energy: 1.2070857501026409
Energy: 1.1807988571787027
Energy: 1.1753512056017643
Energy: 1.29932197244831
Energy: 1.1754072906799713
Energy: 1.173776377839856
Energy: 1.1774447437538973
Energy: 1.1772156773603388
Energy: 1.1737102415849876
Energy: 1.2992810399751864
Energy: 1.1769214666516443
Energy: 1.1745974515449358
Energy: 1.1320204278138513
Energy: 1.175361110950097
Energy: 1.1735977702449205
Energy: 1.5639632720599421
Energy: 1.1583564056849065
Energy: 1.1239210008858784
Energy: 1.1664024872679648
Energy: 1.1706483882203669
Energy: 1.1262524223847583
Energy: 1.5714647053358994
Energy: 1.1916303023762516
Energy: 1.1891061375474676
Energy: 1.1214918027951253
Energy: 1.1978171856910147
Energy: 1.1545401360581093
Energy: 1.5988918890623438
Energy: 1.1505161871397707
Energy: 1.1505195053582078
Energy: 1.139868553116357
Energy: 1.1961455401566086
Energy: 1.1745004966203398

minimum gb energy = 1.0981703384328636 eV
minimum distance =  2.29411150927848 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.7241137506686395
Energy: 1.1898561995425996
Energy: 1.192515336030721
Energy: 1.5098782493036491
Energy: 1.51957808513842
Energy: 1.196983115705735
Energy: 1.2331617513112725
Energy: 1.190916428831844
Energy: 1.1899986658699973
Energy: 1.2017106775669377
Energy: 1.191202445384797
Energy: 1.1408298963660495
Energy: 1.4787476736253211
Energy: 1.1899564115346828
Energy: 1.189547156791422
Energy: 1.1774431461519725
Energy: 1.1905092503588401
Energy: 1.1400725839745771
Energy: 1.4755568949391733
Energy: 1.1989241997029831
Energy: 1.1716519209067842
Energy: 1.1738681310839907
Energy: 1.1989628954599525
Energy: 1.174014166649887
Energy: 1.3648937520341908
Energy: 1.2034291265167165
Energy: 1.205231896897731
Energy: 1.1945857386689744
Energy: 1.2033695186524942
Energy: 1.1412863753647733
Energy: 1.4527698057947793
Energy: 1.2030987674611675
Energy: 1.1774470127857668
Energy: 1.1805731062478744
Energy: 1.2023485089315165
Energy: 1.1781846022947617
Energy: 1.4514101245764366
Energy: 1.1781412273982765
Energy: 1.1786965540087684
Energy: 1.1790036818320289
Energy: 1.1828622910121365
Energy: 1.1775109435162652
Energy: 1.3678844631891192
Energy: 1.1923369969063757
Energy: 1.1934831411066757
Energy: 1.206058282134319
Energy: 1.235407563313797
Energy: 1.1913518642349201
Energy: 1.2282404173910049
Energy: 1.1906740276035934
Energy: 1.145632633157704
Energy: 1.2260861421047358
Energy: 1.1902411182050212
Energy: 1.2075721143044427
Energy: 1.2114735296443548
Energy: 1.1944795381716913
Energy: 1.1930488805398236
Energy: 1.206887967377408
Energy: 1.1943857017535924
Energy: 1.203893922929401
Energy: 1.2702496453745027
Energy: 1.132770753215407
Energy: 1.1329180660941098
Energy: 1.2716645695296065
Energy: 1.1331607174630378
Energy: 1.1332781505857352
Energy: 1.1901942961644223
Energy: 1.136597967633286
Energy: 1.1771120952813536
Energy: 1.1902200011982071
Energy: 1.1917223836724269
Energy: 1.1655212639991481
Energy: 1.1904070150432027
Energy: 1.2051642371779445
Energy: 1.1402186272647923
Energy: 1.1907145612011187
Energy: 1.2004377243840336
Energy: 1.1896385757575938
Energy: 1.308465073407924
Energy: 1.174121341750619
Energy: 1.1737535320476364
Energy: 1.3085881985911818
Energy: 1.1741120032472763
Energy: 1.1750952025592856
Energy: 1.2109436856858142
Energy: 1.1938127439229504
Energy: 1.1936697438667268
Energy: 1.2037859932988975
Energy: 1.1947431912487372
Energy: 1.2041121217674329
Energy: 1.2134430460298569
Energy: 1.1813310154827172
Energy: 1.1810272581750496
Energy: 1.2098967238818308
Energy: 1.1773128106078765
Energy: 1.1835292430613196
Energy: 1.3784961171576866
Energy: 1.178110245081003
Energy: 1.1791499959605725
Energy: 1.2057706340807457
Energy: 1.1803346526510667
Energy: 1.178894866002993
Energy: 1.232243591394773
Energy: 1.1843756111432826
Energy: 1.1442095971579136
Energy: 1.2176883099959055
Energy: 1.1803782842748152
Energy: 1.190676078650668
Energy: 1.2330698638832707
Energy: 1.2099399953945935
Energy: 1.2108083485753702
Energy: 1.2130777223457796
Energy: 1.204027773295523
Energy: 1.1451136101360395
Energy: 1.3658071863545957
Energy: 1.2033956595474233
Energy: 1.2051827419761636
Energy: 1.193509402663479
Energy: 1.2038661710995522
Energy: 1.2009110880505276
Energy: 1.7174157942435695
Energy: 1.1793968675295237
Energy: 1.133488563580582
Energy: 1.134115529505923
Energy: 1.2453828948326573
Energy: 1.1333683040311
Energy: 1.6944265698109997
Energy: 1.190135641986274
Energy: 1.1897551936331405
Energy: 1.1919403638242105
Energy: 1.2104393091957628
Energy: 1.177317858614418
Energy: 1.376723059476474
Energy: 1.1908630711896437
Energy: 1.1898684395273182
Energy: 1.1995367900585492
Energy: 1.1912091418339568
Energy: 1.1419893736707742
Energy: 1.4760711553346166
Energy: 1.1775684383643417
Energy: 1.1884345247182442
Energy: 1.3629574762615946
Energy: 1.2243222164010887
Energy: 1.2028014344706048
Energy: 1.3742610390664798
Energy: 1.1308834586284213
Energy: 1.1307511244798678
Energy: 1.2004210695038018
Energy: 1.2061066184362932
Energy: 1.200373582125766
Energy: 1.4811798951319577
Energy: 1.221534442083686
Energy: 1.1805059851106945
Energy: 1.182305304979023
Energy: 1.2241905166108504
Energy: 1.181797351191401
Energy: 1.478063783992337
Energy: 1.1771415204189895
Energy: 1.1785875129338244
Energy: 1.1792592599062441
Energy: 1.2058227105864328
Energy: 1.178686988125593
Energy: 1.3669206125497642
Energy: 1.1907415788389797
Energy: 1.1916636452100278
Energy: 1.2076072074650295
Energy: 1.1916500288524554
Energy: 1.1438197510695958
Energy: 1.212973257618489
Energy: 1.190591246867108
Energy: 1.1908534191714604
Energy: 1.2107112563602485
Energy: 1.1921894800721813
Energy: 1.1818084419539465
Energy: 1.2139012876828839
Energy: 1.193242405465969
Energy: 1.1922978133710567
Energy: 1.2119399529504058
Energy: 1.1932804829230304
Energy: 1.204514484699419
Energy: 1.2712071528254039
Energy: 1.133301766933044
Energy: 1.1329140709643635
Energy: 1.2045254118248077
Energy: 1.133297610185901
Energy: 1.1329081148098237
Energy: 1.1994152607268747
Energy: 1.0968805095618392
Energy: 1.0978447215782814
Energy: 1.2003740095065452
Energy: 1.096270854607669
Energy: 1.1660158917164076
Energy: 1.1911548740601454
Energy: 1.1950787101146008
Energy: 1.1401751876058497
Energy: 1.1912950381821916
Energy: 1.1954805218463582
Energy: 1.1899287188904
Energy: 1.2010858152987678
Energy: 1.1742183174835708
Energy: 1.1738936251567522
Energy: 1.2023157744981474
Energy: 1.2037322250594527
Energy: 1.1788895999013227
Energy: 1.2113848715037123
Energy: 1.1978072771660222
Energy: 1.1423896857594367
Energy: 1.2037364269771467
Energy: 1.1999234645259418
Energy: 1.1311972042600944
Energy: 1.2284538873506623
Energy: 1.109903272149907
Energy: 1.14818364578176
Energy: 1.2249940701622797
Energy: 1.2029422281952937
Energy: 1.1800831831437097
Energy: 1.212630399909751
Energy: 1.1777788721937292
Energy: 1.178142103635805
Energy: 1.2032744816734553
Energy: 1.1780056905924086
Energy: 1.1779874623641255
Energy: 1.2326446259646522
Energy: 1.1484667803242445
Energy: 1.1470222377168164
Energy: 1.203786006797682
Energy: 1.147786033436358
Energy: 1.1462341318146008
Energy: 1.247026762138265
Energy: 1.2040663708572212
Energy: 1.2033957729718137
Energy: 1.2196877616876254
Energy: 1.2041133961555623
Energy: 1.1909458617126132
Energy: 1.3650774552082099
Energy: 1.2007642960672968
Energy: 1.202809081630111
Energy: 1.2021288798513488
Energy: 1.208430999131925
Energy: 1.1406736639980883
Energy: 1.6533891412297705
Energy: 1.177444666081018
Energy: 1.1326351499165412
Energy: 1.1335616534560415
Energy: 1.2042255053001887
Energy: 1.1328560722950511

minimum gb energy = 1.096270854607669 eV
minimum distance =  2.34361070011314 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.6305598467757043
Energy: 1.2984272888968194
Energy: 1.298628643399037
Energy: 1.471562835557254
Energy: 1.2725616847506354
Energy: 1.2448078697449454
Energy: 1.3432171146648424
Energy: 1.2365344410721253
Energy: 1.2364761636051045
Energy: 1.237651850446986
Energy: 1.2270652600086251
Energy: 1.1915949069534981
Energy: 1.4965845269548899
Energy: 1.227366433214162
Energy: 1.2271959882075862
Energy: 1.2112719927943656
Energy: 1.2295041613424031
Energy: 1.1436771634579932
Energy: 1.489178936355249
Energy: 1.1507842993360942
Energy: 1.1439523148447361
Energy: 1.194163737317927
Energy: 1.1335779517589928
Energy: 1.190602664122566
Energy: 1.2863526077799847
Energy: 1.2224954589094363
Energy: 1.2211816180442165
Energy: 1.1934471302168042
Energy: 1.2225401490203136
Energy: 1.1909339016733842
Energy: 1.2859929649664048
Energy: 1.2220986974505965
Energy: 1.2211531838261491
Energy: 1.27159771911074
Energy: 1.229837139739371
Energy: 1.219493571961321
Energy: 1.2857487701498111
Energy: 1.1927181458893281
Energy: 1.1925016265089925
Energy: 1.2718271948839208
Energy: 1.19600028563652
Energy: 1.2207705638181228
Energy: 1.402775482207947
Energy: 1.155415071510554
Energy: 1.1568843248128615
Energy: 1.2124337618448042
Energy: 1.1556370801837714
Energy: 1.1527688171882842
Energy: 1.2296544353729755
Energy: 1.1305532237179707
Energy: 1.131293562192337
Energy: 1.2296700190721157
Energy: 1.1553464727863823
Energy: 1.1432589628571672
Energy: 1.22748112349814
Energy: 1.10224106572104
Energy: 1.102505814694495
Energy: 1.2276308407008232
Energy: 1.1382181480953903
Energy: 1.2273052044842194
Energy: 1.2290172162670863
Energy: 1.1497137667276875
Energy: 1.1498504606422424
Energy: 1.2270983122846322
Energy: 1.1492344648494657
Energy: 1.1399748755413899
Energy: 1.2304475476819292
Energy: 1.1018065871202183
Energy: 1.1793300793087231
Energy: 1.2342061266252646
Energy: 1.130230023288919
Energy: 1.1810285482749086
Energy: 1.2289203911301538
Energy: 1.1608278930480957
Energy: 1.1574141206275248
Energy: 1.2307165274640206
Energy: 1.16241467836507
Energy: 1.1964401773066722
Energy: 1.2311185067759758
Energy: 1.2034682024237922
Energy: 1.1938036069402829
Energy: 1.234479812812243
Energy: 1.1936057580441486
Energy: 1.1935247767827188
Energy: 1.3441328035637077
Energy: 1.1366574728863978
Energy: 1.1379335955513274
Energy: 1.1594529284818365
Energy: 1.1370343535274448
Energy: 1.1377359774067866
Energy: 1.344096523819168
Energy: 1.2341957161265014
Energy: 1.2040665756266722
Energy: 1.298180686857881
Energy: 1.2336750910391727
Energy: 1.196624071494066
Energy: 1.4298684337980694
Energy: 1.2336850237748946
Energy: 1.2468836250722448
Energy: 1.1416172245478038
Energy: 1.2328504947496994
Energy: 1.2175306774235168
Energy: 1.6402661748635385
Energy: 1.1885163843216566
Energy: 1.1731613413127004
Energy: 1.151661304363205
Energy: 1.1881113581461618
Energy: 1.1263215409556178

minimum gb energy = 1.1018065871202183 eV
minimum distance =  2.3314315824114 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.5347077201622519
Energy: 1.2856724153999697
Energy: 1.2682267603337292
Energy: 1.2696998222529607
Energy: 1.2355151488231395
Energy: 1.4097373987955208
Energy: 1.26179613109897
Energy: 1.180061419702941
Energy: 1.1178618124842017
Energy: 1.1402368828707337
Energy: 1.1801896146425133
Energy: 1.1398355742035367
Energy: 1.1242942841112493
Energy: 1.1842437179132697
Energy: 1.184105139777305
Energy: 1.1617663736507688
Energy: 1.1838230623695098
Energy: 1.184303245053078
Energy: 1.295689009955826
Energy: 1.2308737724290004
Energy: 1.2307984417924571
Energy: 1.270619966583895
Energy: 1.2488657916399994
Energy: 1.1622680909241536
Energy: 1.4938073538040317
Energy: 1.330373089620556
Energy: 1.2312360394953459
Energy: 1.133394732663722
Energy: 1.2309489682005188
Energy: 1.277927597327949
Energy: 1.3991290820585187
Energy: 1.1575332331502608
Energy: 1.3569160971090204
Energy: 1.266432613146898
Energy: 1.1575210536470364
Energy: 1.263004833558448
Energy: 1.3706536847989235
Energy: 1.3293908756644028
Energy: 1.2681228147844859
Energy: 1.2584613963797386
Energy: 1.1760993119482492
Energy: 1.2552840180292903
Energy: 1.3762091836523536
Energy: 1.0933701940979852
Energy: 1.0928003199333238
Energy: 1.3678018421703293
Energy: 1.2690195730248168
Energy: 1.0205547485140851
Energy: 1.2364479706298308
Energy: 1.0818588102352116
Energy: 1.0873191695002495
Energy: 1.2362982462865646
Energy: 1.029085929457885
Energy: 1.053004820038312
Energy: 1.236751091568194
Energy: 1.2092841476644836
Energy: 1.2375090393255355
Energy: 1.236636378304863
Energy: 1.172370405674604
Energy: 1.1988414085295473
Energy: 1.236141598856574
Energy: 1.2698727723278112
Energy: 1.2686703133754003
Energy: 1.2360625220045487
Energy: 1.2712770820062513
Energy: 1.1983266392115473
Energy: 1.323315558947089
Energy: 1.2075899294872157
Energy: 1.2304980003178114
Energy: 1.3324213404448075
Energy: 1.2796732754870173
Energy: 1.3318367843022976
Energy: 1.1573550552408807
Energy: 1.3290201998379596
Energy: 1.3280716933764753
Energy: 1.1576439695275196
Energy: 1.329517449399286
Energy: 1.3557434604945477
Energy: 1.3371977315878374
Energy: 1.3181385007656865
Energy: 1.318308715706494
Energy: 1.3108886775279804
Energy: 1.3172127121896162
Energy: 1.3432919486031782
Energy: 1.3648538760696336
Energy: 1.2843886869250338
Energy: 1.2746946927449934
Energy: 1.026981570087237
Energy: 1.2776166082367761
Energy: 1.0211116468636392
Energy: 1.3669984077327388
Energy: 1.2570512788841188
Energy: 1.0564552613390272
Energy: 1.2691810507914676
Energy: 1.3399128225465418
Energy: 1.0282711106726556
Energy: 1.4724286187227076
Energy: 1.3000579097590292
Energy: 1.2997933487502291
Energy: 1.287516959814156
Energy: 1.2976373989412042
Energy: 1.2969013928429507
Energy: 1.2927535853069332
Energy: 1.3000699692195965
Energy: 1.3003202873354869
Energy: 1.2707421271187669
Energy: 1.2967565928252913
Energy: 1.2972457603017618
Energy: 1.2928225621325542
Energy: 1.283065217218972
Energy: 1.2831970107291295
Energy: 1.2704595533025855
Energy: 1.2195341407192282
Energy: 1.310571345635819
Energy: 1.3554845781254614
Energy: 1.1576728656351296
Energy: 1.4018859983010472
Energy: 1.4191700461554213
Energy: 1.1577193998797244
Energy: 1.3024012535954197
Energy: 1.3609139991571544
Energy: 1.2650021083603389
Energy: 1.2775673875524858
Energy: 1.2544077710561337
Energy: 1.2571910981759855
Energy: 1.2822426685408965
Energy: 1.3616907454077116
Energy: 1.253571378821308
Energy: 1.244824965383196
Energy: 1.2605617747040938
Energy: 1.2834843621380505
Energy: 1.2630449860035906
Energy: 1.3937688510896282
Energy: 1.269170595015043
Energy: 1.0888696096231276
Energy: 1.2992690011077035
Energy: 1.3416527893667933
Energy: 1.1496522920602819
Energy: 1.2460435861822845
Energy: 1.24403280552056
Energy: 1.233755599353892
Energy: 1.2448200700440701
Energy: 1.0864942760418312
Energy: 1.245227084580538
Energy: 1.2461030442757683
Energy: 1.2609102057968844
Energy: 1.2634073702843875
Energy: 1.2464147931769622
Energy: 1.3660326663832127
Energy: 1.2467055912002187
Energy: 1.4648613009420772
Energy: 1.2671907195873324
Energy: 1.1983156799639607
Energy: 1.3323610405868909
Energy: 1.2697316685072777
Energy: 1.1022139888928844
Energy: 1.1763432449947402
Energy: 1.2629258331635915
Energy: 1.2891182614000622
Energy: 1.1785011320787535
Energy: 1.263387179525668
Energy: 1.1843041078748486
Energy: 1.1574023790864145
Energy: 1.285027385820948
Energy: 1.1796607724353834
Energy: 1.1575176261160631
Energy: 1.1610377631757196
Energy: 1.351707121458668
Energy: 1.4230551948285204
Energy: 1.211506803517914
Energy: 1.1789505870753354
Energy: 1.2061146361889794
Energy: 1.211130378193765
Energy: 1.2116959545071064
Energy: 1.5447082856719485
Energy: 1.1533661030671152
Energy: 1.0207435793461737
Energy: 1.2710534846080783
Energy: 1.1860146588500806
Energy: 1.1571071868494698

minimum gb energy = 1.0205547485140851 eV
minimum distance =  2.30649864979949 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.1873952844320264
Energy: 1.26663348189158
Energy: 1.2674124679307188
Energy: 1.1823074280060901
Energy: 1.0413983271430562
Energy: 1.2647635669994564
Energy: 1.1597785593713579
Energy: 1.1025951038520816
Energy: 1.1026817997673115
Energy: 1.0907551798302129
Energy: 1.1026478381333333
Energy: 1.0233686590295126
Energy: 1.1086814975053638
Energy: 1.096167160522978
Energy: 1.0951711746448836
Energy: 1.05782687195308
Energy: 1.096325353659368
Energy: 1.0946314105660429
Energy: 1.4906883801769373
Energy: 1.058986258546309
Energy: 1.0593739919777256
Energy: 1.0832420642707559
Energy: 1.1577400497675303
Energy: 1.0020002893529292
Energy: 1.2377046965093839
Energy: 1.1283845982274316
Energy: 0.9856602270369934
Energy: 1.1572951383138792
Energy: 1.1300154347116853
Energy: 0.9852230350953606
Energy: 1.1021361169277442
Energy: 0.9407639660930123
Energy: 0.9414543564434453
Energy: 1.1022123604045884
Energy: 0.9408218830248121
Energy: 0.941137119334281
Energy: 1.0964266543591965
Energy: 0.9860389177228224
Energy: 1.0226621076029887
Energy: 1.0965201045988007
Energy: 1.045198404218311
Energy: 1.0222646839434157
Energy: 1.1030345781908981
Energy: 1.0538070981541159
Energy: 1.0531144535592694
Energy: 1.1508418186197218
Energy: 1.0481032112528739
Energy: 1.0535939450699134
Energy: 1.1092533954174717
Energy: 1.0414884862867402
Energy: 0.9667120089951218
Energy: 1.1030666341629904
Energy: 1.0683675607386234
Energy: 1.0236705585157357
Energy: 1.1101376258548075
Energy: 1.0438726873213209
Energy: 0.9989349760653425
Energy: 1.104499263141462
Energy: 1.094963451938256
Energy: 1.0430512326991825
Energy: 1.109063023035249
Energy: 1.0992305339825856
Energy: 1.0890834053994078
Energy: 1.0948237383536912
Energy: 1.0982601697963847
Energy: 1.0433369404436763
Energy: 1.1106778837876117
Energy: 1.0951054421763609
Energy: 1.0224916255930652
Energy: 1.0230141496177505
Energy: 1.0942573587031499
Energy: 1.0228802417577825

minimum gb energy = 0.9407639660930123 eV
minimum distance =  2.34143146699302 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.8215700457701516
Energy: 1.216439161953015
Energy: 1.0186323253769503
Energy: 0.8937862499753841
Energy: 1.1078615206397584
Energy: 0.8941906972906405
Energy: 0.9562721205845157
Energy: 0.933952888925319
Energy: 0.9338032641459719
Energy: 0.9083924259654086
Energy: 0.9343280733449316
Energy: 0.9289188007887772
Energy: 0.9358346285872632
Energy: 0.9318670848173254
Energy: 0.932390487203773
Energy: 0.8942591250102894
Energy: 0.9310760770694463
Energy: 0.9192071459450507
Energy: 1.191048603310519
Energy: 0.9319297624400221
Energy: 0.916983569467874
Energy: 0.9048275669490516
Energy: 0.930113797200355
Energy: 0.9975362048523053
Energy: 1.000594712492081
Energy: 0.9236726831694755
Energy: 0.8992516111655819
Energy: 0.9725153002518044
Energy: 0.9234978125635804
Energy: 0.9513265517461528
Energy: 0.949425959348103
Energy: 0.9531504652813895
Energy: 0.8654302748166539
Energy: 0.9496359972339627
Energy: 0.954935202702206
Energy: 0.9067600790417879
Energy: 0.95336356833348
Energy: 0.8820833007701377
Energy: 0.9418643011944581
Energy: 0.954415081843352
Energy: 0.9493487141428755
Energy: 0.953020209533667
Energy: 0.9301811131618254
Energy: 0.9476462356980363
Energy: 0.9242978643482881
Energy: 0.9307096544396102
Energy: 0.9481969355067347
Energy: 0.9253970585335335
Energy: 0.9159328271526217
Energy: 0.9321825962377148
Energy: 0.923015958221554
Energy: 0.9329070964132224
Energy: 0.9354352375982766
Energy: 0.8882451549495899
Energy: 1.3975677207252768
Energy: 0.9519488681319568
Energy: 0.9253240553831844
Energy: 0.8691324053558064
Energy: 0.9138737981519106
Energy: 0.9395624898999226
Energy: 0.8865724450035839
Energy: 0.9291188200568341
Energy: 0.9284054278848617
Energy: 0.8331580276081878
Energy: 0.9394036499395372
Energy: 0.9942107027697428
Energy: 0.9164223600144858
Energy: 0.9525909090344375
Energy: 0.9527381006726482
Energy: 0.928415573508791
Energy: 0.9571888118056644
Energy: 1.0019281759384333
Energy: 1.6059470279340564
Energy: 1.0414550276332142
Energy: 0.9269535151388972
Energy: 0.9987455893239812
Energy: 1.0406008431675149
Energy: 1.1615018947571392
Energy: 1.029464927499208
Energy: 0.952615894292883
Energy: 1.009982111227706
Energy: 0.9485895133207447
Energy: 0.9529043634746396
Energy: 0.9311944899780503
Energy: 0.9309598048488779
Energy: 0.9394008662074248
Energy: 0.9403364013174663
Energy: 0.9309315749088175
Energy: 0.9665369367948566
Energy: 0.9920091386390848
Energy: 0.9344328494477925
Energy: 0.9335144857074696
Energy: 0.9198658735772002
Energy: 0.9344111076588237
Energy: 0.9377125053046214
Energy: 0.9476636272118399
Energy: 0.9322633359068281
Energy: 0.895752051776461
Energy: 0.9308065957852354
Energy: 0.9324160592708223
Energy: 0.8949895513754379
Energy: 0.9342106448514844
Energy: 0.9374045059554829
Energy: 0.9257029295274761
Energy: 0.9483815685936471
Energy: 0.9329054023122608
Energy: 0.8995869149597073
Energy: 0.9487269156444225
Energy: 0.9352392146745064
Energy: 0.9008337338273628
Energy: 0.9128617878061944
Energy: 0.9201297725079377
Energy: 0.9110741193886325
Energy: 0.9128509184867767
Energy: 0.9340388459775999
Energy: 0.9195499105111269
Energy: 0.9184374651551257
Energy: 0.9182542327860383
Energy: 0.9171568808720445
Energy: 0.8913557092668153
Energy: 0.9346052767560379
Energy: 0.9193866151081829
Energy: 0.9182787625447344
Energy: 0.9338695466131612
Energy: 0.9199765989151207
Energy: 0.9176018153084493
Energy: 0.9779539225805878
Energy: 0.9339245356983387
Energy: 0.9787449605378287
Energy: 0.9755791552294
Energy: 0.9351016106519889
Energy: 0.9055712843251019
Energy: 0.9709031845827695
Energy: 0.9362242532300289
Energy: 0.9345958258332158
Energy: 0.9812122148994255
Energy: 0.9353476191868944
Energy: 0.8551408478454077
Energy: 0.9351418395390415
Energy: 0.9348632674420017
Energy: 0.9318954521901727
Energy: 0.9365186777390787
Energy: 0.9354721334153147
Energy: 0.9456392669560858
Energy: 1.1827065918751543
Energy: 0.9308100322297884
Energy: 0.9921221643372448
Energy: 0.8926075858459019
Energy: 0.9307849551348573
Energy: 0.9916683966744473
Energy: 0.9334445479092651
Energy: 0.9008482553850251
Energy: 0.8806988037086194
Energy: 0.9438387400416135
Energy: 0.9006045613583284
Energy: 0.9295812520807941
Energy: 1.2664725391052838
Energy: 1.1287293631254653
Energy: 1.128945740119571
Energy: 1.2669300456091919
Energy: 0.9752384603806175
Energy: 0.9127023971549512
Energy: 0.9670373807270195
Energy: 0.8843932604744162
Energy: 0.9345377921730034
Energy: 0.9669884821457634
Energy: 0.9008655959548052
Energy: 0.9626824033728624
Energy: 0.934881483937128
Energy: 0.9211091382113856
Energy: 0.888677262277366
Energy: 0.9348268206912618
Energy: 0.9431038481684807
Energy: 0.9068834747395409
Energy: 0.9175736260803502
Energy: 0.9472125164785442
Energy: 0.9212842261077439
Energy: 0.918389753209156
Energy: 0.9056862553940368
Energy: 0.9245612365602339
Energy: 0.8868025487418005
Energy: 0.9639364531441758
Energy: 0.9656252351141217
Energy: 0.8344528001570706
Energy: 0.9615973427664724
Energy: 0.9959236180329768
Energy: 1.3954435423793394
Energy: 0.9260804150583426
Energy: 0.9258692855700408
Energy: 0.8638422768588248
Energy: 0.9249982300063364
Energy: 0.9825045680070644
Energy: 0.933071625135314
Energy: 0.9530143254734321
Energy: 0.9526623042272421
Energy: 0.9485182252539687
Energy: 0.9527438252182812
Energy: 0.9674209249538374
Energy: 1.1847851740295121
Energy: 0.9498940398344864
Energy: 0.9511811490062597
Energy: 0.9238758485952242
Energy: 0.9491510475147468
Energy: 0.9488086517571536
Energy: 0.9295866782646308
Energy: 0.9644532601784602
Energy: 0.9622977450991894
Energy: 0.9156612326495175
Energy: 0.967373860420564
Energy: 0.8815704537081746
Energy: 0.9318118627727984
Energy: 0.9377728490784488
Energy: 0.9502035996236569
Energy: 0.9307134281402981
Energy: 0.9388318928654347
Energy: 0.9799631808254469
Energy: 0.9349382365821267
Energy: 0.9348423804463437
Energy: 0.9172679488704844
Energy: 0.9361480110449081
Energy: 0.94714922730364
Energy: 0.9317927039134519
Energy: 0.9323881094158192
Energy: 0.9009360461380344
Energy: 0.9006242628683344
Energy: 0.9325450109807721
Energy: 0.9107048018368814
Energy: 0.9337223009597696
Energy: 0.9405843752127913
Energy: 1.0059118645961085
Energy: 1.0237684819632054
Energy: 0.940823159519326
Energy: 1.0851056415290006
Energy: 0.9483184355585498
Energy: 0.9343070099866323
Energy: 0.9009802899914198
Energy: 0.9000321176604297
Energy: 0.9352372865613339
Energy: 0.9003679806038581
Energy: 0.9130871977552144
Energy: 0.9321801064484657
Energy: 0.9189998943752846
Energy: 0.8917610918590664
Energy: 0.9292802787138287
Energy: 0.9211077500183495
Energy: 0.9192285972633868
Energy: 0.9349160127748246
Energy: 0.9186363913259541
Energy: 0.9184051097588515
Energy: 0.9185957784802911
Energy: 0.9180549430508996
Energy: 0.9190308047355779
Energy: 0.9717618556505973
Energy: 0.9357482475785852
Energy: 0.9345910244773902
Energy: 0.9802250396173773
Energy: 0.9352592488850633
Energy: 0.8551723431132272

minimum gb energy = 0.8331580276081878 eV
minimum distance =  2.32684493486295 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.3894005277437781
Energy: 0.40269777214610997
Energy: 0.403169255305864
Energy: 0.39302579985187197
Energy: 0.4557013858581111
Energy: 0.3905957063779737
Energy: 0.39012042325176327
Energy: 0.45285953079413543
Energy: 0.4148771228561249
Energy: 0.45072255923726606
Energy: 0.45218644234636024
Energy: 0.4669438464615481
Energy: 0.5171379633951017
Energy: 0.45362924852128417
Energy: 0.4530456340660205
Energy: 0.45187135836597797
Energy: 0.45343887787474363
Energy: 0.45339973389810334
Energy: 0.5173927999275311
Energy: 0.45421814030397917
Energy: 0.4544538940504862
Energy: 0.45293796069446846
Energy: 0.5170515689880251
Energy: 0.4535134623692488
Energy: 0.5131029106886806
Energy: 0.39064506303995644
Energy: 0.4340088131066995
Energy: 0.5144633047693604
Energy: 0.3902498294232888
Energy: 0.46745696998022485
Energy: 0.45377282256220436
Energy: 0.39019278670611235
Energy: 0.39132110996220343
Energy: 0.45385129222629805
Energy: 0.3900686219122569
Energy: 0.43369155984455215
Energy: 0.4480200253333106
Energy: 0.41423569660480636
Energy: 0.4144752307146879
Energy: 0.44924143841834774
Energy: 0.4532815940165217
Energy: 0.468452441448459
Energy: 0.4536193289936481
Energy: 0.5245183785143709
Energy: 0.5242517963905818
Energy: 0.4536820793250748
Energy: 0.4527178686214159
Energy: 0.4539409717551058
Energy: 0.5122973969531719
Energy: 0.4525913344677891
Energy: 0.4699755607475629
Energy: 0.513699459937798
Energy: 0.4515788188752775
Energy: 0.45366746572869776
Energy: 0.3899663526411472
Energy: 0.4527301814464464
Energy: 0.4359496740214159
Energy: 0.3900161871122424
Energy: 0.516962581719264
Energy: 0.4353914101900082
Energy: 0.3901172499004471
Energy: 0.41456069729691536
Energy: 0.41512184992953804
Energy: 0.3901632383613996
Energy: 0.4536874943489229
Energy: 0.4340735632513474
Energy: 0.5156683463393479
Energy: 0.4528079964816006
Energy: 0.453132950911683
Energy: 0.5158979512282253
Energy: 0.4521540385672521
Energy: 0.41519073522822264
Energy: 0.5165222025119303
Energy: 0.5174189051043306
Energy: 0.5237589399049771
Energy: 0.5233922277088183
Energy: 0.5175407328690701
Energy: 0.5232718794746738
Energy: 0.513938240981144
Energy: 0.4523235085457971
Energy: 0.4532263278668907
Energy: 0.5158932505695563
Energy: 0.45197851888800916
Energy: 0.415479551778824
Energy: 0.517568690183682
Energy: 0.39015363577400297
Energy: 0.3904418124652934
Energy: 0.5166984046516069
Energy: 0.39017189208999503
Energy: 0.3910868412543129
Energy: 0.4520730588448999
Energy: 0.472244818042825
Energy: 0.4699391310204184
Energy: 0.45225844378065533
Energy: 0.390381210554189
Energy: 0.4146054566454324
Energy: 0.4532458882348975
Energy: 0.4528157551400951
Energy: 0.4699606068288815
Energy: 0.4532124173253375
Energy: 0.45216326026645065
Energy: 0.4536127840366797
Energy: 0.5169879804980511
Energy: 0.4525509484922378
Energy: 0.5227781506030617
Energy: 0.5173270094994876
Energy: 0.4530893077911007
Energy: 0.4539947000131016
Energy: 0.39016803781239046
Energy: 0.4719188299319521
Energy: 0.414986738987906
Energy: 0.39017897543934854
Energy: 0.5158310708160084
Energy: 0.4711212878642311

minimum gb energy = 0.3894005277437781 eV
minimum distance =  2.36646698163409 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.5432714064585225
Energy: 0.7712608301287486
Energy: 1.059177158178113
Energy: 1.0215201570042374
Energy: 1.041920967569355
Energy: 0.9948417082354515
Energy: 0.7497851452726944
Energy: 0.7254410808648395
Energy: 0.7848802463170496
Energy: 0.7574660179226517
Energy: 0.7256207501776352
Energy: 0.7641280263961644
Energy: 0.7321674024477197
Energy: 0.7287574399167467
Energy: 0.7287387287890487
Energy: 0.7334081337217134
Energy: 0.7284840929874731
Energy: 0.7283085496400695
Energy: 0.7314758005784355
Energy: 0.7348619117671187
Energy: 0.7439384985957643
Energy: 0.7325156656426102
Energy: 0.7310462325006576
Energy: 0.7273193717340778
Energy: 0.7263405258726728
Energy: 0.8301268449271461
Energy: 0.8254997756400543
Energy: 0.7263417708710528
Energy: 0.8608097312257895
Energy: 0.780913937157394
Energy: 0.7941149875169112
Energy: 0.7865740629271621
Energy: 0.8441404032947137
Energy: 0.7612669945849617
Energy: 0.7766815077429788
Energy: 0.7912461501079375
Energy: 0.797346911309636
Energy: 0.7432685506352031
Energy: 0.7294790475314619
Energy: 0.7282712758378134
Energy: 0.735841697840314
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Energy: 0.7515597008609175
Energy: 0.8375697171824458
Energy: 0.837948320783223
Energy: 0.7519897883042251
Energy: 0.8361619893178697
Energy: 0.8270400946171468
Energy: 0.7978960170314008
Energy: 0.7354864653727781
Energy: 0.7592390134845665
Energy: 0.7604575487138513
Energy: 0.7317615008651415
Energy: 0.7742217492538236
Energy: 0.9853627405677082
Energy: 0.8124928380690822
Energy: 0.7908660803243646
Energy: 0.730762167910889
Energy: 0.7290156961103187
Energy: 0.7861655498484181
Energy: 0.8433143900394766
Energy: 0.8438752755741762
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Energy: 0.8582998791545765
Energy: 0.8445184048509902
Energy: 0.8101841037394226
Energy: 0.9105374258802501
Energy: 0.7027563837737419
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Energy: 0.7617039003016778
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Energy: 0.7029601956390675
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Energy: 0.8569177092778654
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Energy: 0.7620093239625083
Energy: 0.8563088482394164
Energy: 0.7859390452093464
Energy: 0.8061958171530513
Energy: 0.8558109274517787
Energy: 0.7853550522891986
Energy: 0.8051097759704238
Energy: 0.8621081085953098
Energy: 0.9753462717810188
Energy: 0.9907454740615401
Energy: 0.8573416090506466
Energy: 0.9737685054757486
Energy: 0.8443275859678738
Energy: 1.087673545265582
Energy: 0.8563662138634556
Energy: 0.8031091087616093
Energy: 0.8566828360731957
Energy: 0.8575322571185525
Energy: 0.857611772010515
Energy: 1.108788651229916
Energy: 0.8529476337184543
Energy: 0.7657137445296971
Energy: 1.1144836348158362
Energy: 0.9214371095677852
Energy: 0.7661625034988219
Energy: 0.8515581543387739
Energy: 0.845300071628568
Energy: 0.786013194755133
Energy: 0.7583373596131641
Energy: 0.8563108705817662
Energy: 0.8042822522077394
Energy: 1.0520144866914396
Energy: 0.763496020651997
Energy: 0.7647607715981093
Energy: 0.7312916980346403
Energy: 0.8562179812482746
Energy: 0.7886776019225427
Energy: 0.9333413581706161
Energy: 0.9429995975819858
Energy: 0.8571008835420268
Energy: 0.9505187153817192
Energy: 0.9923850705239295
Energy: 0.7634896103602687
Energy: 1.0874197087515955
Energy: 0.8041314530872934
Energy: 0.8401311980595738
Energy: 0.7298386318564456
Energy: 0.8622775301332409
Energy: 0.786836386895378
Energy: 0.7316837655771129
Energy: 1.0089071078308762
Energy: 0.7800819629095489
Energy: 0.7298550427217283
Energy: 0.7658675960084177
Energy: 0.9153064115921702
Energy: 0.7324409891402759
Energy: 0.7624301434764413
Energy: 0.8106735660403124
Energy: 0.7325539797758972
Energy: 0.7643925551523365
Energy: 0.7903542575594813
Energy: 0.8329545721614018
Energy: 0.7280858961291871
Energy: 0.7322522964315624
Energy: 0.832647962281719
Energy: 0.7278336923816162
Energy: 0.7321160029732251
Energy: 0.8404803876791854
Energy: 0.7274898387399106
Energy: 0.727392669463605
Energy: 0.8414163669387031
Energy: 0.7319030063764042
Energy: 0.7428518842196212
Energy: 0.8428054198975147
Energy: 0.7882491009259536
Energy: 0.7830082129903272
Energy: 0.959075590268459
Energy: 0.7591867438194956
Energy: 0.7641280751358519

minimum gb energy = 0.7027563837737419 eV
minimum distance =  2.30970140508704 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.5247901737060714
Energy: 0.8360678217196761
Energy: 0.8361943993448302
Energy: 1.1652391924279957
Energy: 0.8833854530403598
Energy: 1.1658438901078934
Energy: 0.8472539577510533
Energy: 0.8101628264804805
Energy: 0.8591879354655203
Energy: 0.8441476586918375
Energy: 0.8094957333020139
Energy: 0.8593354626657193
Energy: 0.8116630278055704
Energy: 0.8114874759651645
Energy: 0.811716657729944
Energy: 0.8126005510268927
Energy: 0.8110808019515394
Energy: 0.8172771245064422
Energy: 0.8117943470874147
Energy: 0.858905155166063
Energy: 0.8428223416487872
Energy: 0.8129613045351481
Energy: 0.8120694193949489
Energy: 0.8127676205412109
Energy: 0.8087916095858663
Energy: 0.9005357511396872
Energy: 0.9004631960890661
Energy: 0.808877196660748
Energy: 0.8195613492181324
Energy: 0.8570954111103809
Energy: 0.9183176134421167
Energy: 0.8666480576390125
Energy: 0.8660863497473207
Energy: 0.8513712169182303
Energy: 0.8601257035094979
Energy: 0.8156797823837625
Energy: 0.9202381771334147
Energy: 0.811594690178994
Energy: 0.8594535882149864
Energy: 0.8110063442913217
Energy: 0.8227791868355055
Energy: 0.8594869178387123
Energy: 0.8468021886248481
Energy: 0.8680585059371381
Energy: 0.8691187001234794
Energy: 0.849558110690214
Energy: 0.86794505337377
Energy: 0.8878459595006077
Energy: 0.9173906093990994
Energy: 0.813269374537804
Energy: 0.9002981436479973
Energy: 0.8554314858085446
Energy: 0.8193140247605176
Energy: 0.8597240993527815
Energy: 1.1283704631933953
Energy: 0.8184568037964549
Energy: 0.8179982068016735
Energy: 0.8970607233071217
Energy: 0.8184709841556893
Energy: 0.8912255322532003
Energy: 1.2148613985831074
Energy: 0.8537726872193647
Energy: 0.8573501249787687
Energy: 0.8137726203079793
Energy: 0.8179656617516492
Energy: 0.9004064469395867
Energy: 1.103297881090375
Energy: 0.8165789825531111
Energy: 0.8564386239164798
Energy: 1.0339998440908913
Energy: 0.7730632973077796
Energy: 0.8575415095846867
Energy: 0.8174115173376324
Energy: 0.816741233463205
Energy: 0.847301813100407
Energy: 0.8171863863702362
Energy: 0.7741350060840032
Energy: 0.8659783146928979
Energy: 0.8182306551536224
Energy: 0.8586078982503206
Energy: 0.8592360875879322
Energy: 0.8186627366432606
Energy: 0.8660662662038421
Energy: 0.9006137125993127
Energy: 0.8697426178146143
Energy: 0.898427756284798
Energy: 0.8688250002291917
Energy: 0.8698587465091424
Energy: 0.9016508851803774
Energy: 0.8703453614677678
Energy: 0.8097273199103452
Energy: 0.8106905902762417
Energy: 0.8591185318865737
Energy: 0.8221215967524061
Energy: 0.810579329689835
Energy: 0.8595426882605104
Energy: 1.409818823646074
Energy: 0.8415555374906658
Energy: 0.8131805329503347
Energy: 1.2051656146079852
Energy: 0.8087600555463097
Energy: 0.8675991668551191
Energy: 0.8468985848199073
Energy: 0.8875303141358835
Energy: 0.8605990979122748
Energy: 1.03885099931009
Energy: 0.8088351844823782
Energy: 0.8576906239596364
Energy: 0.8127169640218109
Energy: 0.812198481441486
Energy: 0.8125247662148904
Energy: 0.8126807754794374
Energy: 0.8117700402051017
Energy: 0.81707251776528
Energy: 0.8105568462489411
Energy: 0.8122924871288052
Energy: 0.8178351997132264
Energy: 0.8113565749241066
Energy: 0.8124974363106474
Energy: 0.8130479625618674
Energy: 0.8091784052362837
Energy: 0.8599510367178977
Energy: 0.8602362078205119
Energy: 0.8091575944710516
Energy: 0.8195962401394706
Energy: 0.860982077441475
Energy: 0.9182611850268715
Energy: 0.9886158271714045
Energy: 0.9853809908237218
Energy: 0.9214510936691981
Energy: 0.9851965795995795
Energy: 0.9864609510381862
Energy: 0.9194719389118712
Energy: 0.8599986884667856
Energy: 0.8593851373968624
Energy: 0.8096773557853765
Energy: 0.845440874106675
Energy: 0.8598601195038068
Energy: 0.8478629030089252
Energy: 0.9823314159040585
Energy: 0.8245596943587657
Energy: 0.8499301822919693
Energy: 0.9814702551101392
Energy: 0.8910946604189155
Energy: 0.9204726072462995
Energy: 0.8198061163794088
Energy: 0.8596155964376472
Energy: 0.8542410419951152
Energy: 0.8209494446725629
Energy: 0.8591328170497031
Energy: 1.2022844578694534
Energy: 0.8615093993786985
Energy: 0.8543165927651358
Energy: 0.8137160006072985
Energy: 0.8176434815906074
Energy: 0.9003015898887361
Energy: 1.1306646003801106
Energy: 0.8620869453031486
Energy: 0.8908585806629671
Energy: 0.8972342749016861
Energy: 1.0365553411770552
Energy: 0.8585681037262403
Energy: 1.1842688144911588
Energy: 0.8151160745818743
Energy: 0.9004811546771159
Energy: 0.8170977726263139
Energy: 0.7716828107530794
Energy: 0.9002764687863036
Energy: 0.8169719965899499
Energy: 0.8655576909056617
Energy: 0.8659723959378428
Energy: 0.8171807200267065
Energy: 0.8654435873250791
Energy: 0.8654958608492342
Energy: 0.904853920622189
Energy: 0.8519219858376906
Energy: 0.9002364784923553
Energy: 0.9049763382994631
Energy: 0.8610142249601006
Energy: 0.8998677613982651
Energy: 0.8187384459701759
Energy: 0.8987191534703374
Energy: 0.8191738490426075
Energy: 0.8186487390641437
Energy: 0.810697809492215
Energy: 0.8190548086623329
Energy: 0.8109661369136184
Energy: 0.8123022848762879
Energy: 0.8553914938527989
Energy: 0.8458236374243988
Energy: 0.8120336708287254
Energy: 0.817767962365792
Energy: 1.5726122401092943
Energy: 0.8883761945170839
Energy: 0.8583199506368434
Energy: 0.7777830517954073
Energy: 0.8089674643843556
Energy: 0.8560451745361439

minimum gb energy = 0.7716828107530794 eV
minimum distance =  2.31948511592215 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.1248196506464079
Energy: 0.9337031573025443
Energy: 0.8872484813852042
Energy: 1.0757984630258415
Energy: 1.0576639754401926
Energy: 0.933962550197981
Energy: 0.9959211914077306
Energy: 0.926938346434586
Energy: 0.9152472114099907
Energy: 0.8730819516675791
Energy: 0.9003617026983517
Energy: 0.9635133147774456
Energy: 0.993471856800731
Energy: 0.9922228137332695
Energy: 0.9615810897681645
Energy: 1.001306331929376
Energy: 0.9019844295913446
Energy: 0.9924422185586047
Energy: 0.9931705028717916
Energy: 0.9371181393263643
Energy: 0.9760156103311242
Energy: 1.0000970115540806
Energy: 0.9982461624670117
Energy: 0.9105679972913524
Energy: 0.9958737412270723
Energy: 0.9399459275843174
Energy: 0.9512352837728141
Energy: 1.007282194447498
Energy: 0.9575893805727207
Energy: 0.9146297844974306
Energy: 1.0805089486183228
Energy: 0.9148558673869616
Energy: 0.9000622683333487
Energy: 1.09779610638297
Energy: 0.9885782918613922
Energy: 0.9263170283218366
Energy: 1.04608407358165
Energy: 1.0249631328399587
Energy: 0.9847961056564677
Energy: 1.0080404429307526
Energy: 1.0284571986398756
Energy: 0.9834521747912082
Energy: 1.007539833180098
Energy: 1.0623054103949299
Energy: 0.9613904256164196
Energy: 1.0083870972827265
Energy: 1.0702789867066353
Energy: 0.9378332510050642
Energy: 1.0452231681143822
Energy: 0.9446463552637764
Energy: 0.9447183623722832
Energy: 1.0957399113775204
Energy: 0.9443101481628886
Energy: 0.9325999681473658
Energy: 1.046242624516547
Energy: 0.9514360099640705
Energy: 0.9514709991510485
Energy: 0.9917632817372426
Energy: 0.9517683929954921
Energy: 0.9781748130532263
Energy: 1.0452059553559716
Energy: 0.9354445770316411
Energy: 0.9717170255978108
Energy: 0.9925322717140399
Energy: 0.945226026675185
Energy: 0.969770233108935
Energy: 1.3026167831520095
Energy: 0.8516179720672649
Energy: 0.8518895890495072
Energy: 0.998211785374607
Energy: 0.858559691672714
Energy: 0.8503335095684855
Energy: 0.9896116526040596
Energy: 0.8529766689094015
Energy: 0.8506341182005964
Energy: 1.0020653090604705
Energy: 0.8513640934276315
Energy: 0.8850274764806565
Energy: 0.995773829876438
Energy: 1.0237604295911389
Energy: 0.9694920786496317
Energy: 0.9973820441453293
Energy: 1.0643171817384343
Energy: 0.9526728258412207
Energy: 0.8978289768622566
Energy: 1.0002557800297067
Energy: 0.9802322712806874
Energy: 0.9979336409660474
Energy: 1.0752416673469223
Energy: 0.9790998438618423
Energy: 0.9918855164585615
Energy: 1.01236860196784
Energy: 0.9888707303409014
Energy: 1.0223469161528886
Energy: 1.0001533267096192
Energy: 0.9678205658836156
Energy: 1.3995714089447604
Energy: 1.1298515293938693
Energy: 0.9016437450179168
Energy: 1.2958937930616674
Energy: 1.1299297911980621
Energy: 0.9015426832382105
Energy: 1.0118820257917862
Energy: 1.0679136813682992
Energy: 0.9563187347686581
Energy: 0.9635610542189744
Energy: 1.0640485934211596
Energy: 0.9557778153940784
Energy: 0.9930384527601037
Energy: 1.0059817505943638
Energy: 0.9888871574923254
Energy: 1.058624786104962
Energy: 1.0062298686333595
Energy: 1.0024948118847916
Energy: 0.9465451465627692
Energy: 0.9312239837023386
Energy: 0.9026928087542337
Energy: 0.9462566477797759
Energy: 1.0067086548685529
Energy: 1.0100319652435865
Energy: 0.94499716779789
Energy: 0.9918705098085914
Energy: 0.937842041952055
Energy: 0.9448802454055099
Energy: 1.0168043165396266
Energy: 0.9448402756956682
Energy: 0.9731901731096746
Energy: 0.9936505126697691
Energy: 1.0450226653093737
Energy: 0.973069315510413
Energy: 1.012762910046079
Energy: 0.977674917372893
Energy: 1.0004015397745392
Energy: 0.9579486048166485
Energy: 0.9530765695491633
Energy: 0.9511926482813062
Energy: 0.9936155402537621
Energy: 0.9205820283543269
Energy: 0.9629166225251269
Energy: 1.2896265224792978
Energy: 0.9223204670509215
Energy: 0.9876536001466768
Energy: 1.11176881517521
Energy: 0.8510994548793835
Energy: 0.956636889120206
Energy: 0.9861032172621355
Energy: 0.9635768331939525
Energy: 0.8528851940229206
Energy: 1.0027881966441763
Energy: 0.9305949260195439
Energy: 1.0029259687808905
Energy: 0.9922055859908769
Energy: 0.9759222372244295
Energy: 1.0021592938249588
Energy: 0.9930498658219378
Energy: 0.9779167504264008
Energy: 1.0034264890765003
Energy: 0.9944954230915098
Energy: 1.0248102803835735
Energy: 1.0037227113754468
Energy: 0.9939752046949285
Energy: 0.978690113158839
Energy: 0.999853095936459
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Energy: 1.2600550842800413
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Energy: 0.9891730400170577
Energy: 0.9010996297154963
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Energy: 0.9807004771351678
Energy: 1.0155228775760257
Energy: 1.007017397779222
Energy: 1.0034894317694574
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Energy: 1.0070270734033573
Energy: 1.046151090501964
Energy: 0.9371126367186391
Energy: 1.0083937224173547
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Energy: 0.9348779094286354
Energy: 0.9918499155450404
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Energy: 0.9730370727911493
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Energy: 0.8509391903971224
Energy: 0.8505189055622071
Energy: 1.0014385087528324
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Energy: 0.9275649212434145
Energy: 0.9897374907731673
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Energy: 0.909053133644562
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Energy: 0.8526176708181599
Energy: 0.904823526462191
Energy: 0.9924585742007342
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Energy: 0.9540384309330507
Energy: 0.994242283912741
Energy: 1.0055513735084392
Energy: 0.9520722032247423
Energy: 0.946690598823181
Energy: 1.0012861591516564
Energy: 1.0208965292432293
Energy: 0.9496911930196331
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Energy: 1.0222473706199533
Energy: 0.9928190372331658
Energy: 1.00102985405439
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Energy: 1.020792675828346
Energy: 1.000873575360313
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Energy: 1.3984405492314278
Energy: 1.0743726001440395
Energy: 1.057398101936397
Energy: 0.9890219503859686
Energy: 1.0905610025279755
Energy: 0.9015152284129632
Energy: 1.0118591740426626
Energy: 1.0687632639668492
Energy: 1.0368871232616643
Energy: 0.9578734403796906
Energy: 1.0659692380173007
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Energy: 0.9969895094337163
Energy: 0.9874322282277402
Energy: 0.9883938528567641
Energy: 1.0278844845111945
Energy: 1.0064289011817573
Energy: 1.014553888246122
Energy: 1.0391264659611397
Energy: 1.0306782560259327
Energy: 0.9046081963265669
Energy: 1.0313719910069967
Energy: 1.0069758851646151
Energy: 0.9048123173685916
Energy: 0.9352300115140202
Energy: 0.9348694730066515
Energy: 0.9379104836676968
Energy: 0.9432387981545655
Energy: 1.0059001892253827
Energy: 0.8686317462754685
Energy: 0.9644683257830665
Energy: 1.030484144273305
Energy: 0.9680397634606309
Energy: 0.9708780975682066
Energy: 0.9837644550614674
Energy: 0.9649662964517873
Energy: 0.9936178780357293
Energy: 0.9658312517791401
Energy: 0.9142542769669285
Energy: 0.8796036236803311
Energy: 0.9032900380646206
Energy: 0.9636777363339494
Energy: 1.6344274056491706
Energy: 0.994100273396702
Energy: 0.9228328608286425
Energy: 0.8865455959783575
Energy: 1.2134706196186797
Energy: 0.9546660018219552

minimum gb energy = 0.8503335095684855 eV
minimum distance =  2.30891103929281 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.2913993009363995
Energy: 0.951771177273112
Energy: 0.9520933819713612
Energy: 1.293582378113258
Energy: 1.0677128825661428
Energy: 0.9519787609485779
Energy: 1.096130372887046
Energy: 0.9717723091061422
Energy: 0.9704640265564977
Energy: 1.0198174209660225
Energy: 1.0197239537164013
Energy: 0.9655190728704601
Energy: 1.0180567011611699
Energy: 0.9226076756091116
Energy: 0.968288209426512
Energy: 1.0180551697410993
Energy: 0.9220205899320384
Energy: 0.9730377843795689
Energy: 1.0191867355475441
Energy: 0.9678631676700057
Energy: 0.9713257818028586
Energy: 1.0138096756049075
Energy: 0.9679535768279405
Energy: 0.9690850632621949
Energy: 1.0121404245371237
Energy: 0.9672136091551515
Energy: 0.967365978009879
Energy: 1.0122984463945262
Energy: 0.9672697643134223
Energy: 0.9680125431084992
Energy: 1.0122248707526817
Energy: 0.9654373464130828
Energy: 0.9702691684686132
Energy: 1.0123180874326587
Energy: 0.9650330918255194
Energy: 1.013703980924423
Energy: 1.0953550842712465
Energy: 0.9658686153391264
Energy: 0.9653889399093999
Energy: 1.0960930786465872
Energy: 1.0137040364777603
Energy: 0.9648288893506752

minimum gb energy = 0.9220205899320384 eV
minimum distance =  2.36233870921935 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.7795562320466438
Energy: 1.2301514222188121
Energy: 1.1481413394788837
Energy: 1.0977019630324951
Energy: 1.7684698597806696
Energy: 1.14752585403363
Energy: 1.0907536101795248
Energy: 1.0645593697898605
Energy: 1.0343840132699564
Energy: 1.128137610130848
Energy: 1.1571892404418418
Energy: 1.0335765231269212
Energy: 1.033870045849628
Energy: 1.0292643851051901
Energy: 1.0287021325550807
Energy: 1.0337278186846957
Energy: 1.0297434802953946
Energy: 1.0350995328282206
Energy: 1.0410729443413556
Energy: 1.034341084573126
Energy: 1.03407928365938
Energy: 1.0420990575675175
Energy: 1.146077206765546
Energy: 1.0340767671786943
Energy: 1.0332359483679314
Energy: 1.033672181110217
Energy: 1.0354558339859894
Energy: 1.0337277458016154
Energy: 1.0874397894865884
Energy: 1.0348928319369604
Energy: 1.033375403955876
Energy: 1.087542294894315
Energy: 1.03697755409689
Energy: 1.0339220087911583
Energy: 1.103629563578954
Energy: 1.035926937212747
Energy: 1.033915653136493
Energy: 1.1596939774052994
Energy: 1.0611228094563234
Energy: 1.0919659676976612
Energy: 1.1622200072688675
Energy: 1.0970024982209539
Energy: 1.6397272795757891
Energy: 1.3774257980439835
Energy: 1.2702121864831186
Energy: 1.0382852922052044
Energy: 1.1746944692206305
Energy: 1.1876768352528444
Energy: 1.0353105330760655
Energy: 1.036382141971009
Energy: 1.0375291904496795
Energy: 1.0954045460396074
Energy: 1.0872180890700773
Energy: 1.0560044035199123
Energy: 1.2380573564163573
Energy: 1.0585410443068
Energy: 1.0586909235054194
Energy: 1.2368669752605517
Energy: 1.0578465294997579
Energy: 1.1563502206989782
Energy: 1.1438196173990833
Energy: 1.0871079892781594
Energy: 1.0909097410188102
Energy: 1.1443182704538815
Energy: 1.0760347385640952
Energy: 1.0345967200767465
Energy: 1.1506799431051065
Energy: 1.0363266464271612
Energy: 1.0353658760327222
Energy: 1.1496885458796477
Energy: 1.034971901765029
Energy: 1.035919497711333
Energy: 1.099744512084629
Energy: 1.0351515332152792
Energy: 1.0358661115537484
Energy: 1.1029781911933354
Energy: 1.0342970016895456
Energy: 1.0365753467025158
Energy: 1.1963840251440112
Energy: 1.0342954588526416
Energy: 1.0341024271965715
Energy: 1.0729605477457598
Energy: 1.040695165261322
Energy: 1.034314091883685
Energy: 1.2070597154646776
Energy: 1.0375670588938959
Energy: 1.0373248330679445
Energy: 1.1105144201220842
Energy: 1.0356520429881912
Energy: 1.0374519303469492
Energy: 1.133685340179174
Energy: 1.0345137978673193
Energy: 1.0345579175318942
Energy: 1.0713704999179432
Energy: 1.081361777536302
Energy: 1.0827565577900693
Energy: 1.2912732479635556
Energy: 1.1004405659520136
Energy: 1.1016604519964013
Energy: 1.291962240176606
Energy: 1.1149863615710272
Energy: 1.1152801773464935
Energy: 1.113866276786065
Energy: 1.086040654326841
Energy: 1.0842108272167508
Energy: 1.1586260558657586
Energy: 1.1186450099268308
Energy: 1.090248739104418
Energy: 1.1475704254515948
Energy: 1.0697434136644006
Energy: 1.0355208215219975
Energy: 1.0472556232108898
Energy: 1.0525074786331157
Energy: 1.0573067349927308
Energy: 1.1275474582314593
Energy: 1.070089584888214
Energy: 1.070151460831362
Energy: 1.0454322394005977
Energy: 1.0909972073116865
Energy: 1.057696741313371
Energy: 1.1037043993833366
Energy: 1.0884572626244096
Energy: 1.084320846646884
Energy: 1.0882559192976566
Energy: 1.0506949144327298
Energy: 1.0961904613044489
Energy: 1.088360840102985
Energy: 1.0943716998087782
Energy: 1.0935351698591287
Energy: 1.0885722695211009
Energy: 1.0851630755453143
Energy: 1.093248532160901
Energy: 1.088357559604965
Energy: 1.0854087382495676
Energy: 1.1330388831638112
Energy: 1.0906258695100155
Energy: 1.0998196599781163
Energy: 1.094586523954288
Energy: 1.100876981573623
Energy: 1.0374657382572356
Energy: 1.0367516351298653
Energy: 1.1008731052917726
Energy: 1.0379136929146102
Energy: 1.1011368375738604
Energy: 1.0322938734567628
Energy: 1.0220636347816396
Energy: 1.022251716589168
Energy: 1.0782039852990506
Energy: 1.198980003990344
Energy: 1.0218987431017388
Energy: 1.327481277793577
Energy: 1.1764289068422147
Energy: 1.1759172777375133
Energy: 1.0629572974540695
Energy: 1.1932164694968659
Energy: 1.1165969755050713
Energy: 1.036435734833927
Energy: 1.1806531884770517
Energy: 1.1769193603760535
Energy: 1.0654719537803392
Energy: 1.0899230518647602
Energy: 1.1175109503963374
Energy: 1.035768159356149
Energy: 1.0226358894087093
Energy: 1.0225280338178937
Energy: 1.034827505232882
Energy: 1.133287417849294
Energy: 1.0220870278404561
Energy: 1.0450332201748989
Energy: 1.030700746851436
Energy: 1.0291960335596517
Energy: 1.0453970572945013
Energy: 1.0316476474824943
Energy: 1.0481401631120328
Energy: 1.0439426096380786
Energy: 1.05367926876864
Energy: 1.053785549953489
Energy: 1.046352993176044
Energy: 1.16617392454192
Energy: 1.0442736897218132
Energy: 1.0443177807445811
Energy: 1.0754272944172343
Energy: 1.0733973034605344
Energy: 1.0444969128964443
Energy: 1.1384702737767765
Energy: 1.0852014251739888
Energy: 1.054490176997206
Energy: 1.0869008267714066
Energy: 1.088602734724038
Energy: 1.0943084392588716
Energy: 1.159281743950888
Energy: 1.0707697293332332
Energy: 1.3089360337091291
Energy: 1.2083111832887077
Energy: 1.1409096184409975
Energy: 1.0356474128128452
Energy: 1.1862103527670325
Energy: 1.101327173276026
Energy: 1.1480176462738727
Energy: 1.1424807075176477
Energy: 1.035037379651963
Energy: 1.0560480288386467
Energy: 1.1307394251973752
Energy: 1.0356708698054515
Energy: 1.0655282216972333
Energy: 1.0908020619875476
Energy: 1.0905802483796583
Energy: 1.104451278569134
Energy: 1.1445290806149082
Energy: 1.0707133420156079
Energy: 1.1773806385128334
Energy: 1.0582597472874704
Energy: 1.0586127202971618
Energy: 1.1776542462001494
Energy: 1.0352460278404567
Energy: 1.1551288999517189
Energy: 1.1315775760249072
Energy: 1.035346604729348
Energy: 1.034575968378046
Energy: 1.1161576337787331
Energy: 1.098062433935577
Energy: 1.1482153336713958
Energy: 1.1438641398979015
Energy: 1.0360398805449962
Energy: 1.0366521267414992
Energy: 1.1023401091485538
Energy: 1.0348270323277575
Energy: 1.0385525610602848
Energy: 1.159843960316261
Energy: 1.0339840322533709
Energy: 1.0340522747705556
Energy: 1.1201641903468957
Energy: 1.0405552540489502
Energy: 1.0346195862802106
Energy: 1.1193886464731917
Energy: 1.034680001824035
Energy: 1.0357257759231353
Energy: 1.0280151633679298
Energy: 1.0340708824643645
Energy: 1.0360656322602866
Energy: 1.1812366282609865
Energy: 1.0343372856786313
Energy: 1.0341909648899839
Energy: 1.0978558157153424
Energy: 1.0685356408324156
Energy: 1.0343010169884614
Energy: 1.139131351670791
Energy: 1.0799357668726224
Energy: 1.0583542216632065
Energy: 1.1413355351927714
Energy: 1.056911808879034
Energy: 1.1154769631428307
Energy: 1.4045327406884656
Energy: 1.1004539510719744
Energy: 1.0987197183607427
Energy: 1.4049854271951705
Energy: 1.075269914998081
Energy: 1.1591570443607708
Energy: 1.1161710395197026
Energy: 1.0348580755525614
Energy: 1.0340848158617075
Energy: 1.0491558621597097
Energy: 1.0697007562955974
Energy: 1.0342245650581607
Energy: 1.5411341262675617
Energy: 1.0898696318606895
Energy: 1.066417043605595
Energy: 1.0706164388688721
Energy: 1.089615248149974
Energy: 1.0693456471613398
Energy: 1.1183033331396706
Energy: 1.0777502737772198
Energy: 1.0965875091555575
Energy: 1.1343319313948244
Energy: 1.0813825430817614
Energy: 1.1021855574711854
Energy: 1.0777508411383812
Energy: 1.0974249111487038
Energy: 1.0682073889626504
Energy: 1.082210005629849
Energy: 1.0972257923714375
Energy: 1.0682301120973576
Energy: 1.0776028351696965
Energy: 1.071866311975228
Energy: 1.0741306030397508
Energy: 1.0779908423034477
Energy: 1.0981712996710724
Energy: 1.0746894379533198
Energy: 1.0884168854400793
Energy: 1.033468881116567
Energy: 1.0341955222379815
Energy: 1.0891761292277997
Energy: 1.0346386109059782
Energy: 1.034480777850969
Energy: 1.1344541747144725
Energy: 1.0342578900579162
Energy: 1.0338342969488348
Energy: 1.1344578038632578
Energy: 1.0342513955585424
Energy: 1.0347607229210378
Energy: 1.0914765927696963
Energy: 1.0363333551829643
Energy: 1.0716674041786318
Energy: 1.1204430863107613
Energy: 1.0865791758359804
Energy: 1.0702613166615669

minimum gb energy = 1.0218987431017388 eV
minimum distance =  2.32393844115409 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.8216497468641972
Energy: 1.0996221290402861
Energy: 1.0978103328572761
Energy: 1.0993042720224393
Energy: 1.1281705276639473
Energy: 1.0972654108044284
Energy: 1.0862078023261748
Energy: 1.0244107814660282
Energy: 1.1005794748797186
Energy: 1.0756424216433595
Energy: 1.024503835181413
Energy: 1.0996594957450876
Energy: 1.0734727554637804
Energy: 1.0530497394049665
Energy: 1.0168947612870123
Energy: 1.0736518021811174
Energy: 1.0186331987018116
Energy: 1.057577139536954
Energy: 1.0560052315072102
Energy: 1.0836844474391707
Energy: 1.0581083165967968
Energy: 1.0561499170557684
Energy: 1.0161356523750655
Energy: 1.0570471855343784
Energy: 1.0564500903033869
Energy: 1.0969923786603275
Energy: 1.0968131478854313
Energy: 1.0565000350528884
Energy: 1.1078208076535496
Energy: 1.096016718475904
Energy: 1.148294446429786
Energy: 1.057270162075831
Energy: 1.0570478191715653
Energy: 1.1059475504480236
Energy: 1.107035900072013
Energy: 1.0567308448152413
Energy: 1.106527675179943
Energy: 1.0248868390721824
Energy: 1.0602212383671474
Energy: 1.0801396341752219
Energy: 1.0249265790435125
Energy: 1.0627830993453051
Energy: 1.0651858673266206
Energy: 1.2026995903448336
Energy: 1.194893381874286
Energy: 1.0935980563524332
Energy: 1.2348459915649215
Energy: 1.1280934609309257
Energy: 1.0511702803383944
Energy: 1.0248155386786668
Energy: 1.0592892858993481
Energy: 1.0764006473179928
Energy: 1.0460421287178323
Energy: 1.0921714105642122
Energy: 1.1092211660273112
Energy: 0.9941516285098202
Energy: 0.9940452872524689
Energy: 1.0939388094713716
Energy: 0.9947361783744939
Energy: 0.993685016061418
Energy: 1.0836864049021866
Energy: 0.9921687339847328
Energy: 0.9919220111389011
Energy: 1.0840519627770446
Energy: 0.9920570915144333
Energy: 1.021633177307322
Energy: 1.0758360652048657
Energy: 1.024789201415051
Energy: 1.0599870426580444
Energy: 1.0152219956238926
Energy: 1.045386132946877
Energy: 1.0594708172617553
Energy: 1.0833196615866933
Energy: 1.0785134202134208
Energy: 1.021606419207428
Energy: 1.018222197140948
Energy: 1.0829197850677188
Energy: 1.0154940722011634
Energy: 1.0836254332493367
Energy: 1.021711556793569
Energy: 1.085168746650272
Energy: 1.0734817015617077
Energy: 1.0614334538641241
Energy: 1.0943614609963284
Energy: 1.0815457562744757
Energy: 1.119747059797209
Energy: 1.1778601509757503
Energy: 1.103397052964625
Energy: 1.1113485163655623
Energy: 1.0910636619996041
Energy: 1.0740668550453818
Energy: 1.0915996492906772
Energy: 1.1057254100418614
Energy: 1.0744119140226418
Energy: 1.0560444925452475
Energy: 1.1086026190177338
Energy: 1.280027211064767
Energy: 1.0160123679834037
Energy: 1.035560558356914
Energy: 1.279891871742621
Energy: 1.0181232902101367
Energy: 1.1003792409757758
Energy: 1.036188187729607
Energy: 1.0340185529850487
Energy: 1.0722382804827348
Energy: 1.0516293373730832
Energy: 1.1326306803387212
Energy: 1.0733947757140578
Energy: 0.9950007992452867
Energy: 1.0355671571112208
Energy: 0.9925170922034261
Energy: 0.9921094415988898
Energy: 1.1364107147647091
Energy: 0.992553195871622
Energy: 0.9964707911066283
Energy: 1.036055653149213
Energy: 0.9926969952944532
Energy: 1.0510974092537724
Energy: 1.0706120958090475
Energy: 0.9931290376095151
Energy: 1.0360919240854836
Energy: 1.0341630083189997
Energy: 1.0746059470532876
Energy: 1.0518102273944472
Energy: 1.1106764470772608
Energy: 1.0728667819914424
Energy: 1.0836612144570248
Energy: 1.0149399547361395
Energy: 1.131248372886096
Energy: 1.0838156461835562
Energy: 1.0849755897935283
Energy: 1.129451776037765
Energy: 1.0722062579759704
Energy: 1.1453153728081016
Energy: 1.1039454775507505
Energy: 1.0725674528545452
Energy: 1.0557928707170237
Energy: 1.0355571830273185
Energy: 1.1030313350729688
Energy: 1.1417881791369062
Energy: 1.10570453546769
Energy: 1.0367849423203153
Energy: 1.1485117692046296
Energy: 1.1058729662415019
Energy: 1.0837452663373044
Energy: 1.0601736964739037
Energy: 1.0951521909436106
Energy: 1.0759289929280964
Energy: 1.0637150938359563
Energy: 1.0959159076103395
Energy: 1.0627600637226835
Energy: 1.1884768952297544
Energy: 1.0613141829599324
Energy: 1.05640717464125
Energy: 1.2814274979772264
Energy: 1.0593888436066001
Energy: 1.0906911008790914
Energy: 1.024734355077752
Energy: 1.0595182763047715
Energy: 1.1224384808994743
Energy: 1.0449948440584105
Energy: 1.059650300275228
Energy: 1.0822506800218539
Energy: 0.9920841909536118
Energy: 1.0215779409846355
Energy: 1.0748322451348113
Energy: 0.991904568805055
Energy: 1.0212585820479136
Energy: 1.0579441622480126
Energy: 0.9947306582170469
Energy: 0.994742724032314
Energy: 1.057277137473611
Energy: 0.9950254008693838
Energy: 0.9949959220995367
Energy: 1.052504047939986
Energy: 1.0910075516253523
Energy: 1.0589333361135491
Energy: 1.0750115497772512
Energy: 1.046543904206502
Energy: 1.0219577672809284
Energy: 1.0834233021956168
Energy: 1.0895148032128315
Energy: 1.0678834693578665
Energy: 1.01779407317828
Energy: 1.0985909878726445
Energy: 1.0159092939460928
Energy: 1.1073624565485298
Energy: 1.02170328246943
Energy: 1.021839358756458
Energy: 1.0803511283628038
Energy: 1.0219237335143148
Energy: 1.0217679522050316
Energy: 1.0618009649584452
Energy: 1.0693874492798285
Energy: 1.096744344846123
Energy: 1.0962232630280626
Energy: 1.068307255956933
Energy: 1.0978047182028663
Energy: 1.0620917485231969
Energy: 1.0988372325281248
Energy: 1.0997916926514932
Energy: 1.0605615086910232
Energy: 1.073434576393278
Energy: 1.1002890686523306
Energy: 1.0621475717734568
Energy: 1.0995404966262683
Energy: 1.0952689829997357
Energy: 1.0624016056150811
Energy: 1.056191817436628
Energy: 1.095368428425708
Energy: 1.2289617127450863
Energy: 1.0162257238588388
Energy: 1.0159422519923786
Energy: 1.2293526000976043
Energy: 1.0935658406846813
Energy: 1.1680660595464833
Energy: 1.1386007916956136
Energy: 1.0244957938024708
Energy: 1.1005248697288381
Energy: 1.0612846688284612
Energy: 1.024332396578639
Energy: 1.0977453932308696
Energy: 1.3854849659367692
Energy: 1.1626475103503673
Energy: 1.1009393891744221
Energy: 1.0556412501489338
Energy: 1.1574255292768847
Energy: 1.098043800062059

minimum gb energy = 0.991904568805055 eV
minimum distance =  2.32023990167019 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.8143581589628741
Energy: 1.3235118635879863
Energy: 1.2074303982346855
Energy: 1.1119541957429828
Energy: 1.2696452481091536
Energy: 1.111482081866178
Energy: 1.0303312986167974
Energy: 1.0374914544249458
Energy: 1.1010680740096281
Energy: 1.1190393043596778
Energy: 1.0532710718522356
Energy: 1.0523373255996933
Energy: 1.0792393907646358
Energy: 1.031552315252557
Energy: 1.0315354854298306
Energy: 1.0781731833800028
Energy: 1.0311854857491745
Energy: 1.0527363313898765
Energy: 1.0514637375247708
Energy: 1.0308375963086611
Energy: 1.0507928221631175
Energy: 1.0514579239612025
Energy: 1.0311261492168178
Energy: 1.0512674184298127
Energy: 1.0516222349056914
Energy: 1.1054860462039129
Energy: 1.0945482645998943
Energy: 1.051759329720473
Energy: 1.0529298388513841
Energy: 1.0777157495942415
Energy: 1.0521508414206453
Energy: 1.065449817795067
Energy: 1.0943380807124978
Energy: 1.0532434092674074
Energy: 1.0524705043287461
Energy: 1.0947139949566818
Energy: 1.0519518053328598
Energy: 1.0511690768515716
Energy: 1.0514469565528528
Energy: 1.0517813880179028
Energy: 1.0527879914093772
Energy: 1.0519498806619734
Energy: 1.120283896475101
Energy: 1.0541301231059022
Energy: 1.0535302112495428
Energy: 1.0309009659731687
Energy: 1.059012699150984
Energy: 1.0529696047534949
Energy: 1.0556920069145854
Energy: 1.0521671146512837
Energy: 1.0520440784275193
Energy: 1.0557954427154712
Energy: 1.0512392633712178
Energy: 1.0514100581822778
Energy: 1.256433420458063
Energy: 1.0526321498764162
Energy: 1.0523182335826406
Energy: 1.2353619895267516
Energy: 1.0526830012582746
Energy: 1.1249040172455411
Energy: 1.0343295066429472
Energy: 1.0785334219473386
Energy: 1.0313800026659277
Energy: 1.0536484081125723
Energy: 1.0687905137273306
Energy: 1.0999875716531815
Energy: 1.0644876602275002
Energy: 1.051549084824792
Energy: 1.0515296723067324
Energy: 1.0311462681244923
Energy: 1.0507987348095484
Energy: 1.0517762445272394
Energy: 1.0652954326219009
Energy: 1.0534330702180923
Energy: 1.069306731743597
Energy: 1.0326821068244851
Energy: 1.054048111822046
Energy: 1.0692305692118909
Energy: 1.0324913115513739
Energy: 1.051322363883458
Energy: 1.05202526301407
Energy: 1.0534963247423863
Energy: 1.1143818273192407
Energy: 1.1001996951986248
Energy: 1.03435281934337
Energy: 1.0462108564761985
Energy: 1.0384005320502359
Energy: 1.0348041006776183
Energy: 1.0981314173082606
Energy: 1.0457220134187748
Energy: 1.0307941900052735
Energy: 1.0461569354459312
Energy: 1.0326448420440466
Energy: 1.031448847397137
Energy: 1.1157639518225657
Energy: 1.0321760889797038
Energy: 1.0334206393571335
Energy: 1.0363180661094689
Energy: 1.0347633869324844
Energy: 1.0341961968124334
Energy: 1.0311974396131123
Energy: 1.0332971812220886
Energy: 1.033246698859923
Energy: 1.0810410809025885
Energy: 1.0324843292585675
Energy: 1.1216697575443784
Energy: 1.123941319610207
Energy: 1.032491506367218
Energy: 1.131197542127927
Energy: 1.0330103432490312
Energy: 1.033525134299485
Energy: 1.102684358645607
Energy: 1.1195714386298965
Energy: 1.0506424108689036
Energy: 1.1246904574834298
Energy: 1.0335931198502168
Energy: 1.033915137230086
Energy: 1.1576591083324517
Energy: 1.1641893354371446
Energy: 1.0510453999749616
Energy: 1.0324990714665832
Energy: 1.0330464487357216
Energy: 1.080046453598199
Energy: 1.1215705617282432
Energy: 1.07472401855528
Energy: 1.0324780371111326
Energy: 1.2480555831938336
Energy: 1.069870844244322
Energy: 1.090936170477036
Energy: 1.2480875599336898
Energy: 1.0431509759232678
Energy: 1.1680854454843872
Energy: 1.1221802868433295
Energy: 1.0324298526971236
Energy: 1.0330867181530368
Energy: 1.122478731963085
Energy: 1.1220378219323557
Energy: 1.0800274183927376
Energy: 1.1621253063124715
Energy: 1.0355567166448345
Energy: 1.034420073425992
Energy: 1.0312865338195458
Energy: 1.0355185745542022
Energy: 1.0353183143071918
Energy: 1.1224235262442832
Energy: 1.0321883595795116
Energy: 1.032254194744534
Energy: 1.1225661861261333
Energy: 1.0322398773955876
Energy: 1.0320930068759357
Energy: 1.1145960273452957
Energy: 1.0328165847447224
Energy: 1.0338457566582584
Energy: 1.0522844220708745
Energy: 1.0325723274808445
Energy: 1.0461041834507263
Energy: 1.1145479673221084
Energy: 1.0322964129120842
Energy: 1.031752216355403
Energy: 1.1144826037360545
Energy: 1.0372907281232928
Energy: 1.0330477651388759
Energy: 1.1167344881658816
Energy: 1.1008552502698856
Energy: 1.0519416573486258
Energy: 1.114609007528934
Energy: 1.0544867041512762
Energy: 1.0507854740739124
Energy: 1.126865924130628
Energy: 1.051266725148796
Energy: 1.0514260347345883
Energy: 1.1239383765223008
Energy: 1.0365490198516663
Energy: 1.0515180329493667
Energy: 1.0511732869437864
Energy: 1.0376737314280657
Energy: 1.0993608581968493
Energy: 1.1164877546474261
Energy: 1.0534118160494264
Energy: 1.0510623691376688
Energy: 1.0437110578966595
Energy: 1.1920274755709104
Energy: 1.1160899057469993
Energy: 1.070323340062322
Energy: 1.1953992849817066
Energy: 1.03262695609789

minimum gb energy = 1.0303312986167974 eV
minimum distance =  2.33727857720441 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.3466847892551483
Energy: 1.2151396128604046
Energy: 1.117975708653169
Energy: 1.0464403396943383
Energy: 1.5913209178696075
Energy: 1.2172941720513586
Energy: 1.081172136275131
Energy: 1.0966666250731139
Energy: 1.0920715081791614
Energy: 1.1082596441730235
Energy: 1.0981048468510513
Energy: 1.0845124301389881
Energy: 1.1809895753071755
Energy: 1.0506017589545946
Energy: 1.0503918522769258
Energy: 1.0813684197637623
Energy: 1.0506427706283377
Energy: 1.0507254719372243
Energy: 1.1747003313274325
Energy: 1.050115188464796
Energy: 1.050231770208362
Energy: 1.1832857779203447
Energy: 1.0512764124466014
Energy: 1.0358903256233234
Energy: 1.1728349088261394
Energy: 1.1422463314694775
Energy: 1.1568926641169293
Energy: 1.1829107081415295
Energy: 1.1571334167126726
Energy: 1.1431259184873368
Energy: 1.052722339323269
Energy: 1.157003852850554
Energy: 1.1581386841518628
Energy: 1.163746623903101
Energy: 1.1645731530796732
Energy: 1.1644157290625265
Energy: 1.184164592046101
Energy: 1.163986028269882
Energy: 1.1629715772117692
Energy: 1.1712569283235064
Energy: 1.1642368148168605
Energy: 1.163717551194351
Energy: 1.1074973950301115
Energy: 1.2236929935777303
Energy: 1.2113416902241256
Energy: 1.0903603702304936
Energy: 1.214320470347001
Energy: 1.2098567827274642
Energy: 1.1861443113716972
Energy: 1.165311341549356
Energy: 1.165704383968201
Energy: 1.1944503377965368
Energy: 1.1654666640779325
Energy: 1.1640883706748786
Energy: 1.271657528541782
Energy: 1.1061531378720562
Energy: 1.1069133528506678
Energy: 1.2691036045061055
Energy: 1.1077885162953478
Energy: 1.1320442982086525
Energy: 1.1232780598130732
Energy: 1.1064704416543352
Energy: 1.1646662958375076
Energy: 1.1746367178643773
Energy: 1.1912824052348765
Energy: 1.1636814217669467
Energy: 0.9909001019925279
Energy: 1.1698643938852387
Energy: 1.1684303938058986
Energy: 0.9932954603194373
Energy: 1.1637902182218787
Energy: 1.098954452803213
Energy: 0.9912403501835523
Energy: 1.1713496493446272
Energy: 1.0995715580799954
Energy: 1.008557549527814
Energy: 1.1683505843995545
Energy: 1.1024939800549614
Energy: 1.128302071855615
Energy: 1.2128354347105956
Energy: 1.1565717716049935
Energy: 1.175587931494133
Energy: 1.210154122943361
Energy: 1.1669476486993855
Energy: 1.1898688646045643
Energy: 1.0500086952930074
Energy: 1.0498601040146447
Energy: 1.2199845529565712
Energy: 1.0501911305118952
Energy: 1.1036729880099871
Energy: 1.181542319070493
Energy: 1.1483910181696255
Energy: 1.1750420852857586
Energy: 1.180959910329312
Energy: 1.2126565942930396
Energy: 1.1620556221531093
Energy: 1.183726446703701
Energy: 1.1474024195091215
Energy: 1.1473335898251737
Energy: 1.1882342346119357
Energy: 1.1503516568249572
Energy: 1.1479376330154476
Energy: 1.1820028316823123
Energy: 1.166097962471429
Energy: 1.1472723931814395
Energy: 1.1738020915974454
Energy: 1.1661843476131712
Energy: 1.1757152011342518
Energy: 1.1815873261452465
Energy: 1.1644723657106342
Energy: 1.1647635176540627
Energy: 1.1486983660743482
Energy: 1.1635172537549627
Energy: 1.1749468007722992
Energy: 1.1810278898792912
Energy: 1.1630432906928283
Energy: 1.1738621359711472
Energy: 1.19237782416665
Energy: 1.1748320963977648
Energy: 1.1718057260650692
Energy: 1.180954915304984
Energy: 1.189968001314572
Energy: 1.1756425527740582
Energy: 1.1925269337723146
Energy: 1.2578004510861291
Energy: 1.0579728487146856
Energy: 1.245135187452316
Energy: 1.1081657963851648
Energy: 1.1100040867917673
Energy: 1.2198464311983435
Energy: 1.1072563109358267
Energy: 1.1395669643657373
Energy: 1.313877483789088
Energy: 1.1188884600088087
Energy: 1.1222955202769909
Energy: 1.1078927049461473
Energy: 1.1932074944955464
Energy: 1.186153577710587
Energy: 1.0855321726354794
Energy: 1.0937830149333723
Energy: 1.0994951935967523
Energy: 1.0232694572484031
Energy: 1.1240345938731031
Energy: 1.2056669481443776

minimum gb energy = 0.9909001019925279 eV
minimum distance =  2.28915909140804 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.5759989435332864
Energy: 1.2298300306593115
Energy: 1.2290100576131031
Energy: 1.0214272825702067
Energy: 1.1258040254601411
Energy: 1.0193404872430607
Energy: 0.9678597548372917
Energy: 1.0756497984444677
Energy: 1.0757829747049423
Energy: 1.1187190125561315
Energy: 1.0777538201982888
Energy: 1.0161658762841645
Energy: 1.3367187638150881
Energy: 0.9690545899541582
Energy: 0.9685947338322204
Energy: 1.0764085093360158
Energy: 0.9687311185685011
Energy: 0.9685770371554344
Energy: 1.0758274720221208
Energy: 0.9687562168442221
Energy: 0.9685307157452533
Energy: 1.0756891564134963
Energy: 0.9092247866668862
Energy: 1.0800108164040139
Energy: 0.9550865425246756
Energy: 0.9963587727137855
Energy: 0.9962239967632137
Energy: 0.9558295721373861
Energy: 1.0232019770937082
Energy: 0.9963082484517553
Energy: 0.9719945375436554
Energy: 0.9409815144535957
Energy: 0.942881953531201
Energy: 1.004667945574548
Energy: 0.9404211372976864
Energy: 0.9658060485590816
Energy: 0.941737355220038
Energy: 0.9407658302687655
Energy: 0.9408395058209722
Energy: 0.9419941904978395
Energy: 0.9416425370916116
Energy: 0.9770666472270747
Energy: 0.9420305481843076
Energy: 1.0104630524157163
Energy: 1.010730896822932
Energy: 1.0101307368225771
Energy: 1.0098121739444375
Energy: 1.0372504070265096
Energy: 0.9441434047773125
Energy: 1.0183006938526558
Energy: 1.0095904441912567
Energy: 0.9416629623286029
Energy: 0.9954265942265782
Energy: 0.9420006278880694
Energy: 0.9414251576041716
Energy: 0.9945409439866775
Energy: 0.9944867099144543
Energy: 0.941554808983692
Energy: 0.9947672892004241
Energy: 0.9951789893443018
Energy: 1.1182418103138472
Energy: 1.018206568933541
Energy: 0.9964509703874667
Energy: 1.0240149145641515
Energy: 1.077858287910523
Energy: 0.9963205384766337
Energy: 1.0726558282000247
Energy: 1.0749431975850348
Energy: 1.0752216973573785
Energy: 1.0741081026313362
Energy: 1.075185934855988
Energy: 1.0752181306610735
Energy: 1.0721844252121222
Energy: 1.0750827337466826
Energy: 1.0753923044157712
Energy: 1.0129343281031424
Energy: 1.0753269931388567
Energy: 1.0761637688030172
Energy: 1.0869127932966098
Energy: 1.0760569703045124
Energy: 1.0767738995514307
Energy: 1.0770655772125453
Energy: 1.0758698395289605
Energy: 1.0061483748990305
Energy: 1.2225179684577665
Energy: 1.0738328837987727
Energy: 1.08028973824842
Energy: 1.0765218784259758
Energy: 1.073637729923867
Energy: 1.1244117005990293
Energy: 1.3347551798582236
Energy: 1.1148403038940085
Energy: 1.0175648397872508
Energy: 1.0765435138330848
Energy: 1.0886569190196413
Energy: 1.0757147096987432
Energy: 1.0582710490821439
Energy: 1.0754545008003296
Energy: 1.1783188199270511
Energy: 1.1776018076222847
Energy: 1.088242198468316
Energy: 1.1783753352695285

minimum gb energy = 0.9092247866668862 eV
minimum distance =  2.30947643357754 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.6434276600509747
Energy: 1.1930166391671193
Energy: 0.9951657717672296
Energy: 0.9953583983648009
Energy: 1.3121761620922572
Energy: 0.9955916404186529
Energy: 1.1037838588602
Energy: 1.0532401259208126
Energy: 1.0525287735995863
Energy: 1.0528465521956125
Energy: 1.0550744649517454
Energy: 0.9574278635538861
Energy: 1.2685359403628913
Energy: 0.8941685186749837
Energy: 0.9553406155603643
Energy: 1.052110007993701
Energy: 0.8950527820380695
Energy: 0.9550286548412812
Energy: 1.058931723012434
Energy: 0.9553780138812406
Energy: 0.954983049769855
Energy: 1.0541796334739897
Energy: 0.8657105301234056
Energy: 0.9545598426806633
Energy: 0.9245644128277889
Energy: 0.9093191313216383
Energy: 0.9539077324714326
Energy: 0.9255363951612597
Energy: 0.9102273834656324
Energy: 0.949562983500247
Energy: 0.957447397554227
Energy: 0.9091307123209871
Energy: 0.8600820354183989
Energy: 0.8948737701150858
Energy: 0.909763817181173
Energy: 0.9039127903165431
Energy: 0.845836129121943
Energy: 0.910299339150142
Energy: 0.9097173107328141
Energy: 0.8654477486008438
Energy: 0.9132596785810667
Energy: 0.9245426762686622
Energy: 0.8464127194423607
Energy: 0.9153788997671377
Energy: 0.9282770744117493
Energy: 0.9119785770732491
Energy: 0.9166397685600483
Energy: 0.9284026567007485
Energy: 0.8478530604058885
Energy: 0.8952770173938944
Energy: 0.9244032199413226
Energy: 0.849346147440909
Energy: 0.8656236753098493
Energy: 0.8474246700249961
Energy: 0.8488067611357278
Energy: 0.9171810562136595
Energy: 0.9174308457056468
Energy: 0.8486282816681422
Energy: 0.9225884567129384
Energy: 0.9174226151041041
Energy: 0.8681011344815557
Energy: 0.8482658086520779
Energy: 0.92392509686877
Energy: 0.9221921971292018
Energy: 0.8489136175572795
Energy: 0.9226097230458873
Energy: 0.8511237478322423
Energy: 0.8473190239985973
Energy: 0.8483671935788654
Energy: 0.8521028219993062
Energy: 0.8472622578307405
Energy: 0.895645727184767
Energy: 0.9116392878283066
Energy: 0.8952318771394717
Energy: 0.8964816829346176
Energy: 0.9566573218236631
Energy: 0.8993379270012263
Energy: 0.9284254609701624
Energy: 0.9101171391487943
Energy: 0.9047143767673267
Energy: 0.9045342612341568
Energy: 0.9103892357132283
Energy: 0.8657673284392426
Energy: 0.9087286079443496
Energy: 0.9095173060199535
Energy: 0.8957238767066515
Energy: 0.8957174471886333
Energy: 0.9095411442469135
Energy: 0.9133020761470932
Energy: 0.9535181612173727
Energy: 1.17179863794547
Energy: 1.0533532762833044
Energy: 0.9501679563443015
Energy: 0.9109108742097352
Energy: 1.052454068436356
Energy: 0.9544267196927577
Energy: 0.8473752848825958
Energy: 1.0543806153939803
Energy: 1.0547557666521614
Energy: 0.8491220632930009
Energy: 1.0542056419126007
Energy: 0.9077674896942234
Energy: 0.9265887149862854
Energy: 1.0537551599269226
Energy: 1.054421371383101
Energy: 0.9283627284397126
Energy: 1.0536217489971051
Energy: 0.9242465087412175
Energy: 1.1794171225481491
Energy: 1.0543359432329864
Energy: 0.9973550750271116
Energy: 1.054530348452924
Energy: 0.923827057909003
Energy: 0.9557136694887219
Energy: 1.273952739218372
Energy: 0.9080278413463495
Energy: 0.9111368004166166
Energy: 1.33931748928821
Energy: 0.9083590288096434
Energy: 1.052382066745164
Energy: 1.268679602939686
Energy: 1.0537078605670245
Energy: 1.054079245044795
Energy: 1.0559364762372525
Energy: 1.0535811208267722
Energy: 1.0527551339057482
Energy: 0.8601629705814955
Energy: 1.0547963100873705
Energy: 1.1493239538325233
Energy: 0.9405038360751252
Energy: 1.0532671057852405
Energy: 0.9550956697694307
Energy: 0.8622316529790667
Energy: 1.0537822765399105
Energy: 1.0536570706247612
Energy: 0.8659587091968105
Energy: 1.0541720610380676
Energy: 1.0527802095160574
Energy: 1.26896210673881
Energy: 0.8602266202725679
Energy: 1.052570562945091
Energy: 1.0547463742070695
Energy: 0.8595355129020426
Energy: 1.0527907838061041
Energy: 1.0538276821700578
Energy: 0.917634401801549
Energy: 0.9552905526961732
Energy: 1.0540937420958991
Energy: 0.8933129095984857
Energy: 0.955467277033214
Energy: 1.0560627409851784
Energy: 0.9100558051818075
Energy: 0.9551922965841901
Energy: 1.057437343800375
Energy: 0.9115681739160293
Energy: 0.9579456631872248
Energy: 0.9592535886924981
Energy: 0.907996542436073
Energy: 0.9095495582046262
Energy: 0.8922958166958213
Energy: 0.9078510990873785
Energy: 0.9039194964286568
Energy: 0.911286216195946
Energy: 0.9088434763851653
Energy: 0.9096935709864725
Energy: 0.9099241676324421
Energy: 0.910392956253416
Energy: 0.9100699142167975
Energy: 1.0223708040392925
Energy: 0.9253273355153359
Energy: 0.9290269549340492
Energy: 0.9038273646178866
Energy: 0.9097881586060513
Energy: 0.9292430825124539
Energy: 0.8479937549109745
Energy: 0.9155498249601524
Energy: 0.9288175263894896
Energy: 0.8480548543818844
Energy: 0.9164336865967556
Energy: 0.8954562272631761
Energy: 0.8486344807933063
Energy: 0.9199203533217166
Energy: 0.9248029177925703
Energy: 0.8485009827181476
Energy: 0.9194889879822125
Energy: 0.8909252205634829
Energy: 0.8479996639303621
Energy: 0.9198630081993853
Energy: 0.9258332041224909
Energy: 0.8932019303304816
Energy: 0.918900259539358
Energy: 0.924989739914009
Energy: 0.925457693248697
Energy: 0.8476149520478389
Energy: 0.8484010187000867
Energy: 0.9259595738632681
Energy: 0.8485282702472949
Energy: 0.8484249818611752
Energy: 0.9114077805543925
Energy: 0.9284396325527311
Energy: 0.9457333689593539
Energy: 0.9506627634125338
Energy: 0.8463765958329652
Energy: 0.9357163539729032
Energy: 0.9194319893375871
Energy: 0.9019555054041187
Energy: 0.9348515767690689
Energy: 0.9112297045889317
Energy: 0.9020122290269312
Energy: 0.9375896667215977
Energy: 0.9089766014922678
Energy: 0.9322529408023188
Energy: 0.9502700233297215
Energy: 0.909146361292123
Energy: 0.9319396074250834
Energy: 0.9080115929614035
Energy: 1.1683352314749014
Energy: 0.9504254789270232
Energy: 0.9510467748661442
Energy: 0.9088093740781107
Energy: 0.848656445095259
Energy: 0.9542812874224338
Energy: 0.8465214721445032
Energy: 1.0533249559796973
Energy: 1.0525745768786567
Energy: 0.9207214667818411
Energy: 1.0548417419993679
Energy: 0.9566925903635645
Energy: 0.9248784580799286
Energy: 1.053769972509298
Energy: 0.907328670677705
Energy: 0.9238903581839297
Energy: 1.0530001816324346
Energy: 0.9078658133400782
Energy: 1.1936538331677093
Energy: 1.0541610955292782
Energy: 1.0539044729909786
Energy: 1.0549506580605201
Energy: 1.0557489105681106
Energy: 0.9899946570096008
Energy: 1.18125987645651
Energy: 0.9377214253337351
Energy: 1.0528443493588522
Energy: 1.0528595101040332
Energy: 0.9382096191133091
Energy: 1.0518500612511363
Energy: 1.268619185252939
Energy: 0.9892284239544875
Energy: 0.954672453034735
Energy: 1.055870824786769
Energy: 0.924620642329036
Energy: 1.0530721284964073
Energy: 1.0186643273550686
Energy: 1.053695387018265
Energy: 1.0532414572174356
Energy: 1.0190426320107846
Energy: 1.0562428157455583
Energy: 1.052601900759091

minimum gb energy = 0.845836129121943 eV
minimum distance =  2.29079014924281 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.7894886959862429
Energy: 1.1371194574467829
Energy: 0.9698881292780496
Energy: 0.8667421154763388
Energy: 1.4489894946647872
Energy: 0.9633665261044801
Energy: 1.1370473541415071
Energy: 1.0220445668020477
Energy: 0.9195021654685854
Energy: 1.0174224510943448
Energy: 1.0209843571492339
Energy: 0.9078570566087871
Energy: 1.1997880380935952
Energy: 0.8469537846091205
Energy: 0.8413714848525125
Energy: 1.0249474300485166
Energy: 0.8917827980405507
Energy: 0.9315287691878578
Energy: 1.0206481248104986
Energy: 0.8484174221368593
Energy: 0.9309684753822164
Energy: 1.0223248310219522
Energy: 0.8762433347371629
Energy: 0.9310906281734997
Energy: 0.8733694943759132
Energy: 0.8890901573309868
Energy: 0.9185663883282956
Energy: 0.8735096226154155
Energy: 0.8879140279930066
Energy: 0.9138387577424303
Energy: 0.8355098106634538
Energy: 0.8843658315093635
Energy: 0.8420185898569886
Energy: 0.8517344665792337
Energy: 0.8842611867860133
Energy: 0.8484926564030132
Energy: 1.0805596259833121
Energy: 0.8837633881621213
Energy: 0.8841210057335118
Energy: 0.8453102312095463
Energy: 0.8882061012042368
Energy: 0.8770305255579922
Energy: 1.067238268577099
Energy: 0.8491504888866218
Energy: 0.8496770481759232
Energy: 0.8145999481857105
Energy: 0.8493349621435259
Energy: 0.8718237049194362
Energy: 0.812800031903576
Energy: 0.8470824925451357
Energy: 0.8091774594112063
Energy: 0.8147912181334122
Energy: 0.8191293106571365
Energy: 0.8097341089698269
Energy: 0.8110000640048328
Energy: 0.8540037837815618
Energy: 0.8539040314927956
Energy: 0.8114668402669954
Energy: 0.8519297171632915
Energy: 0.8540767965173955
Energy: 0.7831165375005259
Energy: 0.777199579211147
Energy: 0.8433828549934274
Energy: 0.8381194829570215
Energy: 0.7774851890240475
Energy: 0.8429364548453088
Energy: 0.8176116597684158
Energy: 0.7770015100656052
Energy: 0.7769251700730415
Energy: 0.8160792410574442
Energy: 0.7823988160191562
Energy: 0.8220672837301661
Energy: 0.7792559832294605
Energy: 0.8821526410181848
Energy: 0.8492499728531516
Energy: 0.8301529495812789
Energy: 0.8512549685229376
Energy: 0.8491240458989867
Energy: 0.7775240776402753
Energy: 0.8448707139044835
Energy: 0.7768203989531873
Energy: 0.7801027220377004
Energy: 0.7929350735406374
Energy: 0.7766774270445598
Energy: 0.7763485841924207
Energy: 0.8441834290315006
Energy: 0.8433685033104217
Energy: 0.776494126050549
Energy: 0.8868633814528729
Energy: 0.843685910172465
Energy: 0.9428855065471995
Energy: 0.8111014162455177
Energy: 0.8581609585466333
Energy: 0.8498379183383458
Energy: 0.8105959267692714
Energy: 0.8489670653387208
Energy: 0.829489771671121
Energy: 0.8098164668454957
Energy: 0.8099538197328644
Energy: 0.8090079502963103
Energy: 0.8176864537662015
Energy: 0.8477095454797277
Energy: 0.7787499911248218
Energy: 0.8506481560396336
Energy: 0.8564230159339413
Energy: 0.7801314533608003
Energy: 0.8164211848882185
Energy: 0.865771514516904
Energy: 0.8844622610103616
Energy: 0.8581280071180544
Energy: 0.8841929406160717
Energy: 0.8857539391383891
Energy: 0.8286940468592329
Energy: 0.8842609461024287
Energy: 1.114444668985679
Energy: 0.8936582172333167
Energy: 0.894275195612242
Energy: 0.8841673394729115
Energy: 0.8697949042796295
Energy: 0.9285371127784348
Energy: 1.1162756187607634
Energy: 0.8873191854394584
Energy: 0.9269826940310254
Energy: 0.8864977196926876
Energy: 1.0176006707904004
Energy: 0.9130324273771758
Energy: 0.8710932041303411
Energy: 1.0184730897131185
Energy: 0.8845939151974521
Energy: 0.8754492425791978
Energy: 1.0179191428419785
Energy: 0.8837675215246295
Energy: 0.8150136973553274
Energy: 1.0179105110193378
Energy: 1.017653103557293
Energy: 0.8998941918731571
Energy: 1.0223358792877004
Energy: 1.0132785261230295
Energy: 1.1212659533660374
Energy: 0.8837019996402807
Energy: 0.9130987236470509
Energy: 1.0197476461157011
Energy: 0.9227477335528126
Energy: 0.9200323024950556
Energy: 1.2012581547717733
Energy: 0.8910293730718045
Energy: 0.885408139836688
Energy: 1.0160808376809016
Energy: 0.8908908182940223
Energy: 1.0172058744089625
Energy: 1.2042660858897514
Energy: 1.0177396471372813
Energy: 1.0176486212028995
Energy: 1.023496772510316
Energy: 1.0230248534712336
Energy: 1.0171627693601883
Energy: 0.9337553513840681
Energy: 1.017264375827228
Energy: 0.931917911763256
Energy: 0.8512911388275968
Energy: 1.0169362212480506
Energy: 0.9319042407294279

minimum gb energy = 0.7763485841924207 eV
minimum distance =  2.29257643759175 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.9068940738021293
Energy: 1.0125722839681568
Energy: 0.8699554318609348
Energy: 0.7562149102753919
Energy: 0.948949520008664
Energy: 0.8127473511749408
Energy: 0.9905346574685855
Energy: 0.8113791993877402
Energy: 0.8125203993248368
Energy: 0.9013278391470577
Energy: 0.8003359984498082
Energy: 0.7516243294508975
Energy: 1.0362544354891672
Energy: 0.7491128322516062
Energy: 0.7354668019630736
Energy: 0.9009070595592512
Energy: 0.7486109995700747
Energy: 0.7467021180054673
Energy: 0.9014645591092139
Energy: 0.7341620310879131
Energy: 0.7466719909588266
Energy: 0.800105719069958
Energy: 0.7609031727893366
Energy: 0.8363243178715272
Energy: 0.8393622363571649
Energy: 0.7968511022253326
Energy: 0.7985268554461171
Energy: 0.8787827724709973
Energy: 0.7995733004077663
Energy: 0.8000482695202908
Energy: 0.7076944258305008
Energy: 0.7968041233460946
Energy: 0.7438101986570427
Energy: 0.7253098807081718
Energy: 0.7965832687472922
Energy: 0.7392857027696473
Energy: 0.8914890814263304
Energy: 0.7968592377748263
Energy: 0.7968707160823932
Energy: 0.7450373273630195
Energy: 0.7970341395200501
Energy: 0.7982685157345737
Energy: 0.938395142215426
Energy: 0.715709256250855
Energy: 0.727650934431867
Energy: 0.7501962679890041
Energy: 0.7198315358822195
Energy: 0.7273551071647302
Energy: 0.7339658586215044
Energy: 0.7286952442681205
Energy: 0.730799372610653
Energy: 0.736028607755477
Energy: 0.6725799954840955
Energy: 0.7309966753748128
Energy: 0.7326299723019459
Energy: 0.7167584134532462
Energy: 0.7173008384947678
Energy: 0.7327011535324761
Energy: 0.7140933035061725
Energy: 0.7157503375390141
Energy: 0.688551922666351
Energy: 0.6890759438867488
Energy: 0.7119595712613188
Energy: 0.706463557136447
Energy: 0.6890914469256845
Energy: 0.7072504252576194
Energy: 0.7316118782062223
Energy: 0.6899226969853001
Energy: 0.6895154042614915
Energy: 0.8089601866609727
Energy: 0.6898658958345371
Energy: 0.7216819365516113
Energy: 0.9000464496819611
Energy: 0.7308875034192484
Energy: 0.735434680674084
Energy: 0.9030331941186459
Energy: 0.6987960340724482
Energy: 0.764501246791831
Energy: 0.664920766937535
Energy: 0.7596086866532542
Energy: 0.6648677810513965
Energy: 0.6667881449001131
Energy: 0.6901153541765824
Energy: 0.6647942307643968
Energy: 0.6648263442504048
Energy: 0.6988558342507012
Energy: 0.6988773304009775
Energy: 0.66487330081198
Energy: 0.699303372242384
Energy: 0.6993884247237843
Energy: 0.7778652491896452
Energy: 0.6536369154251528
Energy: 0.6533378198247073
Energy: 0.7051751531837441
Energy: 0.6537262886704204
Energy: 0.6972514907989593
Energy: 0.6700590222560144
Energy: 0.653142091432248
Energy: 0.6531871190480667
Energy: 0.6648916614322311
Energy: 0.6535305247672504
Energy: 0.7021315524077708
Energy: 0.6531771468937575
Energy: 0.7002019526673363
Energy: 0.7036763342407985
Energy: 0.6533059870563848
Energy: 0.7451504675099949
Energy: 0.7041859194726968
Energy: 0.6538995145626338
Energy: 0.7993926421795493
Energy: 0.6533876756902206
Energy: 0.6548198063135894
Energy: 0.892186990086727
Energy: 0.6532487596381246
Energy: 0.885474072696695
Energy: 0.7561272754983921
Energy: 0.7106555624815587
Energy: 0.7840022642131557
Energy: 0.7489598661060701
Energy: 0.7122210417792971
Energy: 0.6947785556978018
Energy: 0.6650399519122887
Energy: 0.6646508364054711
Energy: 0.7037102757520244
Energy: 0.6650156389468944
Energy: 0.7117161017799233
Energy: 0.6552276934969686
Energy: 0.6650026857998661
Energy: 0.6643453767918888
Energy: 0.6898538457188085
Energy: 0.6650572465945911
Energy: 0.7025655032357015
Energy: 0.689461324027117
Energy: 0.7027391703165119
Energy: 0.7028452969181691
Energy: 0.6894598882785617
Energy: 0.7026472842688746
Energy: 0.7030852704558481
Energy: 0.6895941966208847
Energy: 0.77888956584979
Energy: 0.6891573003780274
Energy: 0.6917659305834701
Energy: 0.7311479753219096
Energy: 0.6892306867160216
Energy: 0.9162635795745626
Energy: 0.738495727930027
Energy: 0.7165096647352613
Energy: 0.811441473232597
Energy: 0.7062906469314472
Energy: 0.7510026251541362
Energy: 0.8421273423715377
Energy: 0.7310840506670223
Energy: 0.7311712363130131
Energy: 0.8210858972456049
Energy: 0.731307786833488
Energy: 0.729001826192459
Energy: 0.7071871136139091
Energy: 0.7309850016494442
Energy: 0.7312638615963738
Energy: 0.714571992179416
Energy: 0.7309185141341782
Energy: 0.7208697267323634
Energy: 0.7718281312228813
Energy: 0.7451285486789768
Energy: 0.7465253741164601
Energy: 0.7973510971514465
Energy: 0.7319536401207664
Energy: 0.7421323398166356
Energy: 0.7997975402497899
Energy: 0.7317732717236232
Energy: 0.7971264675782224
Energy: 0.8010603317058417
Energy: 0.6889791847446222
Energy: 0.7969407455305356
Energy: 0.9757506987649646
Energy: 0.7321248181104358
Energy: 0.7315919795929804
Energy: 0.7968799431557538
Energy: 0.7349131239722061
Energy: 0.7410551783044722
Energy: 0.9695806873222858
Energy: 0.7985302555470055
Energy: 0.8126338036032706
Energy: 0.796924937033727
Energy: 0.8587502572107262
Energy: 0.7999679571176241
Energy: 0.7895418040199097
Energy: 0.9017004834140968
Energy: 0.7974410120195519
Energy: 0.7481658309992378
Energy: 0.9016708007572726
Energy: 0.7536107573699501
Energy: 0.8925890887381416
Energy: 0.9018608527255036
Energy: 0.9016051223957651
Energy: 0.7979756361305768
Energy: 0.9051751985834644
Energy: 0.9014657668648748
Energy: 0.9989000681837845
Energy: 0.7894034981090686
Energy: 0.7994120679613179
Energy: 0.8002511945859329
Energy: 0.803937702067948
Energy: 0.9014668948375825
Energy: 1.0353080310999059
Energy: 0.7493931743290404
Energy: 0.7898071912743514
Energy: 0.9008188140653488
Energy: 0.7507598504478655
Energy: 0.78900025890178
Energy: 0.9547544637178095
Energy: 0.901412626377952
Energy: 0.9017141633266862
Energy: 0.9013034170436864
Energy: 0.9021955755971449
Energy: 0.7769760033879176

minimum gb energy = 0.653142091432248 eV
minimum distance =  2.33509850653203 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.04608655016754316
Energy: 0.09924839011889697
Energy: 0.04641570726806247
Energy: 0.04855418549226141
Energy: 0.07510686941010057
Energy: 0.04669805283873485
Energy: 0.10105069120747016
Energy: 0.12530922759050145
Energy: 0.12689986260470176
Energy: 0.09856102539642482
Energy: 0.1252863637598954
Energy: 0.12831794053306572
Energy: 0.07429937095173075
Energy: 0.04663844331653665
Energy: 0.046486332761856784
Energy: 0.09845800953641498
Energy: 0.04689178879669078
Energy: 0.09955237392449538
Energy: 0.12520934359528282
Energy: 0.04692814581364905
Energy: 0.04651186993440479
Energy: 0.04849506279619843
Energy: 0.04671571244619691
Energy: 0.10058412261769444
Energy: 0.09964434318708393
Energy: 0.07440777508838047
Energy: 0.07432702580076939
Energy: 0.10088992740519549
Energy: 0.0745265535628088
Energy: 0.0741926402037755
Energy: 0.04759603313378151
Energy: 0.12505421218010548
Energy: 0.04645023224091603
Energy: 0.04629534806622814
Energy: 0.12566267907823855
Energy: 0.04681657012878147
Energy: 0.09844528244119645
Energy: 0.12684623637760634
Energy: 0.12609600133223084
Energy: 0.09841191302730204
Energy: 0.12531279006052415
Energy: 0.1265978559168417
Energy: 0.07423140169425364
Energy: 0.04655672679560358
Energy: 0.04684995134391976
Energy: 0.07496910388284914
Energy: 0.0465665332486817
Energy: 0.10053605727396785
Energy: 0.12526789824347473
Energy: 0.04665894227871065
Energy: 0.10010405819502015
Energy: 0.048364239226905505
Energy: 0.046792237592280045
Energy: 0.0990748085030548
Energy: 0.04664701611848499
Energy: 0.09846908662148626
Energy: 0.125002439156542
Energy: 0.04642938229799943
Energy: 0.09862190944956574
Energy: 0.12488949840150963

minimum gb energy = 0.04608655016754316 eV
minimum distance =  2.46667336621035 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.8747098369017597
Energy: 0.9188893303690412
Energy: 0.8561324576041763
Energy: 0.7544724099428258
Energy: 0.777775885021523
Energy: 0.7560058175691317
Energy: 0.8253294594152615
Energy: 0.7975518442948587
Energy: 0.7923091657942124
Energy: 0.8415016644659705
Energy: 0.79707389761947
Energy: 0.8103342843109608
Energy: 0.880094292396511
Energy: 0.7886198225619556
Energy: 0.7888742194505737
Energy: 0.8523713795206674
Energy: 0.8348926360557716
Energy: 0.8033109317985538
Energy: 0.7928531185829187
Energy: 0.8347584916904037
Energy: 0.8343634087727287
Energy: 0.7929257608117328
Energy: 0.7150861340851192
Energy: 0.8007720636996796
Energy: 0.7254517350887502
Energy: 0.7974949620142452
Energy: 0.8137318883223453
Energy: 0.7256316440304759
Energy: 0.7962070152918412
Energy: 0.8093107678374518
Energy: 0.7610944912535667
Energy: 0.878536353778476
Energy: 0.7776726180946726
Energy: 0.6810810401547127
Energy: 0.877334686544091
Energy: 0.7154085304080107
Energy: 0.7983840214504639
Energy: 0.7358157857057309
Energy: 0.7354485279563061
Energy: 0.7980194488516528
Energy: 0.7420339336487135
Energy: 0.8137270625026489
Energy: 0.7920381021403337
Energy: 0.7805894182031673
Energy: 0.7806408643418203
Energy: 0.7920405924708781
Energy: 0.7846877931079558
Energy: 0.7266993141191529
Energy: 0.8362662965006453
Energy: 0.8157284208785425
Energy: 0.8478298807894199
Energy: 0.8536389898939966
Energy: 0.6801364535785231
Energy: 0.8464314019846849
Energy: 0.6852862122249057
Energy: 0.7406983722218232
Energy: 0.7410430494653943
Energy: 0.6851595728670656
Energy: 0.7483483542730589
Energy: 0.7380381173144527
Energy: 0.6594360838757486
Energy: 0.773991183188979
Energy: 0.7392962390084671
Energy: 0.6533837175006684
Energy: 0.6548020112899491
Energy: 0.792773985069813
Energy: 0.6882631744939894
Energy: 0.8264250874935045
Energy: 0.8218371914734467
Energy: 0.6858390165876955
Energy: 0.7439885916830726
Energy: 0.6852432492653562
Energy: 0.6987370312575323
Energy: 0.7782522184707557
Energy: 0.7990416473752675
Energy: 0.6987222936385556
Energy: 0.7152456861660283
Energy: 0.6998632281816768
Energy: 0.7966082434346632
Energy: 0.6522455806877245
Energy: 0.7984964395792413
Energy: 0.7386526699976199
Energy: 0.6536330867787096
Energy: 0.8006755977595138
Energy: 0.795482846384321
Energy: 0.6593005205674133
Energy: 0.6599893306864563
Energy: 0.7955491958326573
Energy: 0.6605869642013303
Energy: 0.6573929004380783
Energy: 0.7979651629461291
Energy: 0.7840105465813075
Energy: 0.7827971068593906
Energy: 0.7837641029130608
Energy: 0.7990345270370726
Energy: 0.7825657310728169
Energy: 0.6384992753373909
Energy: 0.7900862355492295
Energy: 0.784861364154578
Energy: 0.6392082832407042
Energy: 0.7860524718159769
Energy: 0.6367339493330093
Energy: 0.6381151298200466
Energy: 0.7837722113053646
Energy: 0.7902018669766191
Energy: 0.6380465309524965
Energy: 0.7843126785010767
Energy: 0.7207842116473477
Energy: 0.8160071047730301
Energy: 0.7186710231678136
Energy: 0.7882327366137853
Energy: 0.7149829826101358
Energy: 0.7200842320218093
Energy: 0.7900423570797166
Energy: 0.7997622707527139
Energy: 0.6374688851071548
Energy: 0.6372040090655694
Energy: 0.8008004181817856
Energy: 0.639193887950851
Energy: 0.6367813607585485
Energy: 0.7987623455382057
Energy: 0.7822357596222658
Energy: 0.783480801506437
Energy: 0.7988562246302313
Energy: 0.809640839394911
Energy: 0.783528838245698
Energy: 0.6608143626220525
Energy: 0.7825180177772757
Energy: 0.7210548373479367
Energy: 0.6619662553650145
Energy: 0.7811762052532017
Energy: 0.6588673018911245
Energy: 0.652218253351731
Energy: 0.7993332554666404
Energy: 0.8003541162339451
Energy: 0.6523136734796234
Energy: 0.8008611002705491
Energy: 0.7983694684986781
Energy: 0.6489983387888804
Energy: 0.6985213182634934
Energy: 0.6998796180407876
Energy: 0.7879425325285296
Energy: 0.6987846770876275
Energy: 0.7843923244111966
Energy: 0.7263270587117913
Energy: 0.6864290299174316
Energy: 0.6860433079877103
Energy: 0.7262077683069876
Energy: 0.6900773683788197
Energy: 0.6854673912239787
Energy: 0.6634780814253122
Energy: 0.807334360539819
Energy: 0.8067554473688253
Energy: 0.6631527287057871
Energy: 0.7786526847521759
Energy: 0.8225618777013922
Energy: 0.7632439050497403
Energy: 0.8066939971411861
Energy: 0.7573518421375652
Energy: 0.7620842628971042
Energy: 0.662722230370804
Energy: 0.7470365277832159
Energy: 0.7031251728505719
Energy: 0.7797744793177461
Energy: 0.7825682388779613
Energy: 0.7030881721965704
Energy: 0.7819524158916876
Energy: 0.7812145809764811
Energy: 0.8264825363007179
Energy: 0.8082321012574506
Energy: 0.7619878318776918
Energy: 0.6687558104990943
Energy: 0.8085190619318987
Energy: 0.6962542274385762
Energy: 0.7365057228374198
Energy: 0.79385749715386
Energy: 0.809909291759861
Energy: 0.736137475940314
Energy: 0.7983452412190268
Energy: 0.7934860139227725
Energy: 0.7440318345485775
Energy: 0.7467713940091611
Energy: 0.7467352103203956
Energy: 0.7444783841100941
Energy: 0.7874990110088766
Energy: 0.747026418267384
Energy: 0.8856431182961139
Energy: 0.8264501331381211
Energy: 0.8529093719164084
Energy: 0.8607759181878611
Energy: 0.6956962751411861
Energy: 0.8137412671362159
Energy: 0.7459844964973178
Energy: 0.7927377771021002
Energy: 0.7929452586638129
Energy: 0.746122804555694
Energy: 0.7973601880289359
Energy: 0.7602631616151991

minimum gb energy = 0.6367339493330093 eV
minimum distance =  2.30124576736264 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.0634085139829899
Energy: 1.0770892015904068
Energy: 0.9949808921222631
Energy: 0.8137916465318731
Energy: 0.904771966273249
Energy: 1.0612629791669062
Energy: 0.978856602049677
Energy: 1.0193239620052743
Energy: 1.0177625666622805
Energy: 1.024631347230202
Energy: 1.0226601083927702
Energy: 1.0182148935646331
Energy: 1.0190207701996465
Energy: 0.9920819301259196
Energy: 1.0232752717182367
Energy: 1.0076512571848826
Energy: 0.9928970829891706
Energy: 1.008711583406038
Energy: 0.9509478612920362
Energy: 1.0216612026546072
Energy: 1.0218739731766036
Energy: 0.9398666388699014
Energy: 0.8393320029817967
Energy: 1.0340607355187181
Energy: 0.9271609862171619
Energy: 1.0186808409086943
Energy: 1.0167550618768435
Energy: 0.9272451983384169
Energy: 1.0216364062818333
Energy: 1.0282697499943556
Energy: 0.9769845319168272
Energy: 0.9336906250112146
Energy: 0.9286329297392266
Energy: 0.8453243166320381
Energy: 0.9337560226395698
Energy: 0.9246139341607419
Energy: 0.9352163504353285
Energy: 0.9533967864099182
Energy: 0.8424937159060965
Energy: 0.9280163358414416
Energy: 0.8450777641008919
Energy: 0.84147378271896
Energy: 0.9532110239875966
Energy: 0.9736992666445026
Energy: 0.8394982176377818
Energy: 0.9360796883119024
Energy: 0.796835665804809
Energy: 0.937125902167287
Energy: 0.798012938074944
Energy: 0.9969370399069959
Energy: 0.9960839674829493
Energy: 1.0001971249728425
Energy: 0.8413935275101362
Energy: 1.0056762632997993
Energy: 0.7929083971346146
Energy: 0.8492187642455965
Energy: 0.844272941024079
Energy: 0.7931277224619779
Energy: 0.8466935775479979
Energy: 0.8438011888559954
Energy: 0.7931882920598263
Energy: 0.9283625222765262
Energy: 0.9302231383547889
Energy: 0.7948585257972387
Energy: 0.9817861699312195
Energy: 0.9266419512719151
Energy: 0.7937821252867353
Energy: 0.9659690576824405
Energy: 0.9648245852709546
Energy: 0.7935933886783466
Energy: 0.8938481769143135
Energy: 0.7934448710022078
Energy: 0.7929394471858493
Energy: 0.9639577537814513
Energy: 0.9615862190915555
Energy: 0.7930627955089583
Energy: 0.7993208557281625
Energy: 0.7920960286344505
Energy: 0.9871984128991429
Energy: 0.9660790259614063
Energy: 0.9621929561927629
Energy: 0.7963470446459069
Energy: 0.8882944853803713
Energy: 0.9609609589408717
Energy: 0.8952886096912831
Energy: 0.7990235844301086
Energy: 0.7935416525688214
Energy: 0.9781523690359615
Energy: 0.7939583015517399
Energy: 0.7936846556937441
Energy: 0.9734538496140851
Energy: 0.964919952863211
Energy: 0.9721417029494687
Energy: 0.8935064962913869
Energy: 0.79424550348583
Energy: 0.9683065363532175
Energy: 0.8468308026686403
Energy: 0.9726044566645395
Energy: 0.8850096762237402
Energy: 0.847710935614181
Energy: 0.7843648820518684
Energy: 0.8433869963689902
Energy: 0.8428825645839262
Energy: 0.9982633648098233
Energy: 1.0013697374640507
Energy: 0.8419103290197752
Energy: 0.8956641011607199
Energy: 0.9384603673296803
Energy: 0.7805623711208781
Energy: 0.8951013506382565
Energy: 0.8804253931352995
Energy: 0.8081977664336812
Energy: 0.8961301205431362
Energy: 0.8802483313793198
Energy: 0.8414412946686165
Energy: 0.9345444092555683
Energy: 0.9333726384166641
Energy: 0.8414128136166454
Energy: 0.9346549030589834
Energy: 0.9398619440432581
Energy: 0.950435086414894
Energy: 1.0003694112317458
Energy: 0.8138023678138995
Energy: 0.958988290771803
Energy: 0.8065969431013834
Energy: 0.8124410167756517
Energy: 1.0193907772736464
Energy: 0.9710213327558855
Energy: 0.8104223942657259
Energy: 1.0198185952672165
Energy: 0.9713558333600382
Energy: 0.9888560944340721
Energy: 0.9787384342658306
Energy: 0.932505683826373
Energy: 0.9284365492435763
Energy: 0.9784570028464036
Energy: 0.9360619111827658
Energy: 0.9279934542915831

minimum gb energy = 0.7805623711208781 eV
minimum distance =  2.29921954162301 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.1667254853989675
Energy: 1.1329203374424186
Energy: 1.1499313319603697
Energy: 1.1751790225673624
Energy: 1.1511022169980347
Energy: 1.1530154676115463
Energy: 1.1192411877763735
Energy: 0.9574304634092952
Energy: 1.0061563757109366
Energy: 1.0240462198381672
Energy: 1.0053414360783595
Energy: 1.044429868137132
Energy: 1.2440419956769635
Energy: 1.1706325151615387
Energy: 1.0940192117421563
Energy: 1.0382048689475727
Energy: 1.128280371779874
Energy: 1.164812505543118
Energy: 1.053161641539061
Energy: 1.098764368609699
Energy: 1.0991444372929904
Energy: 1.1113412687412034
Energy: 1.0283068415154308
Energy: 1.1616740974365036
Energy: 1.0522163021937099
Energy: 1.045288679923122
Energy: 1.0442455450179524
Energy: 1.0553015727796933
Energy: 1.0481643034800483
Energy: 1.0609801585692538
Energy: 0.9243867211690474
Energy: 1.0350063070992443
Energy: 1.0883742753020442
Energy: 0.9422908869228581
Energy: 1.0834709497767177
Energy: 1.0309621043425823
Energy: 1.0524132329695313
Energy: 1.0202831897362625
Energy: 1.0219011798091293
Energy: 1.055903134465478
Energy: 1.020200741213252
Energy: 1.0805914463870085
Energy: 1.0540053205422335
Energy: 1.03559321854325
Energy: 1.0831903950816864
Energy: 1.0579892206383688
Energy: 1.0363001443353344
Energy: 1.0531501015786016
Energy: 1.1703083351118229
Energy: 1.1373989171830212
Energy: 1.132896403153942
Energy: 1.1057030020210343
Energy: 0.9589954793807725
Energy: 1.1336435302161227
Energy: 1.05986312942148
Energy: 0.9589851329633088
Energy: 0.9586911989837563
Energy: 0.9607796609750013
Energy: 0.9615149260353345
Energy: 0.958672941559283
Energy: 1.0149028420968766
Energy: 0.9881450737331551
Energy: 1.1149080127841788
Energy: 0.9806520755627472
Energy: 0.9601491027502098
Energy: 1.1385622166448475
Energy: 0.9583582009505336
Energy: 1.093713976273123
Energy: 0.9565901495900299
Energy: 0.9577203264479994
Energy: 1.0878793195542023
Energy: 0.9566015451877982
Energy: 0.9579808312947482
Energy: 1.1463460771007297
Energy: 1.0724478160140571
Energy: 0.9573907790478372
Energy: 1.028143168673855
Energy: 0.9570091538428385
Energy: 0.8996774573233288
Energy: 1.0803171742508884
Energy: 1.1469375836778646
Energy: 0.9176749498278128
Energy: 1.0871352723891392
Energy: 1.0387757518106377
Energy: 0.8996248779192951
Energy: 1.06370593624418
Energy: 1.0622878684370745
Energy: 0.8986887600023773
Energy: 1.0639251132434842
Energy: 1.0619133487342296
Energy: 0.9749961616305642
Energy: 1.142949146748731
Energy: 1.1420266168855766
Energy: 1.1251414910761606
Energy: 0.9583624691854873
Energy: 1.1265003386878276
Energy: 1.1754375168323496
Energy: 0.9762898628569224
Energy: 1.1487186116835786
Energy: 1.1997417229979468
Energy: 0.9759767573559465
Energy: 1.1415623772633494
Energy: 1.1881578177676757
Energy: 1.0568849202301074
Energy: 1.0549786421051535
Energy: 1.174752457650749
Energy: 1.054056609595703
Energy: 1.1616356784168747
Energy: 0.9156595613181837
Energy: 1.1055826037645515
Energy: 0.9154043167167193
Energy: 0.9127102507581684
Energy: 1.1057478757773602
Energy: 1.1007927154373345
Energy: 1.056951237715293
Energy: 1.057944425369111
Energy: 1.0576108874867571
Energy: 1.056968331888174
Energy: 1.0572019527691003
Energy: 1.0547457423151296
Energy: 1.2061824609279428
Energy: 1.0992283883642975
Energy: 1.0989523076250731
Energy: 1.1999918223440311
Energy: 1.137515930241078
Energy: 1.1650786879949262
Energy: 1.0706581290449004
Energy: 1.0990154119683977
Energy: 1.0992305892328516
Energy: 1.069908880849857
Energy: 1.171699663443079
Energy: 1.18211125288039
Energy: 1.0553928666310235
Energy: 1.0539301702606465
Energy: 1.0584784677526868
Energy: 1.0547511695124239
Energy: 1.0535449397217125
Energy: 0.9873031112904709
Energy: 0.924996053653636
Energy: 1.1129651927474882
Energy: 1.1129232256069683
Energy: 0.9428307387985603
Energy: 1.1131928310020953
Energy: 1.0323279764293398
Energy: 1.0550736936036513
Energy: 1.087202852646083
Energy: 1.08286343856527
Energy: 1.0545843186487542
Energy: 1.084493071902788
Energy: 1.078008120418479
Energy: 1.0587015628887995
Energy: 1.0234233626046783
Energy: 1.0827638032208868
Energy: 1.0569163052596173
Energy: 1.0216055425011041
Energy: 1.0556129389877384
Energy: 1.077434570897243
Energy: 1.098801271695423
Energy: 1.1372270605080252
Energy: 1.13711651748169
Energy: 0.9589400429839756
Energy: 1.1371866333261433
Energy: 1.0550117195429072
Energy: 0.9590465809309426
Energy: 0.9588811366344625
Energy: 1.0469483622110454
Energy: 0.9594528062748741
Energy: 0.9586309562537383
Energy: 0.9542429286854939
Energy: 0.9597686427986042
Energy: 1.0566719150776283
Energy: 0.9808825522473588
Energy: 0.9593296150923473
Energy: 1.1113623951424292
Energy: 0.9552254891254277
Energy: 1.0667077017795645
Energy: 1.0707630052858927
Energy: 0.9583303110906636
Energy: 1.0906025286739847
Energy: 0.9538732817846951
Energy: 0.9561716287673981
Energy: 1.0996789391132344
Energy: 0.9582171596290558
Energy: 0.9590102101382362
Energy: 1.0259325973702236
Energy: 0.9542525814521914
Energy: 0.9012735934017041
Energy: 1.1650868114254882
Energy: 1.1632721836446056
Energy: 0.9225581356866017
Energy: 1.1775136377945583
Energy: 1.0781614510719677
Energy: 0.9008462252343503
Energy: 1.0482293493060877
Energy: 1.054893057541114
Energy: 0.9001634627105235
Energy: 1.0577049897089368
Energy: 1.0609315853704293
Energy: 1.073133935020964
Energy: 1.0385559350774545
Energy: 1.0874757902287846
Energy: 1.083497093151344
Energy: 0.9578080075959331
Energy: 1.0706112782745372
Energy: 1.2120731607387791
Energy: 0.976256520905494
Energy: 1.1765504048718296
Energy: 1.1234112701185457
Energy: 0.916471405312856
Energy: 1.141668959920049
Energy: 1.2082890846523364
Energy: 0.9566987990174466
Energy: 1.0046574270802142
Energy: 1.0346386476853413
Energy: 1.0054448829505689
Energy: 1.136704649116339
Energy: 1.0380714615157434
Energy: 1.010448253665999
Energy: 0.9144516053486882
Energy: 0.9190014553646203
Energy: 1.0099140779843245
Energy: 1.1616652168686186

minimum gb energy = 0.8986887600023773 eV
minimum distance =  2.26991925250681 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.4593950205359367
Energy: 1.4250525264332978
Energy: 1.010020195600138
Energy: 1.0084006664079488
Energy: 1.1866124245430805
Energy: 1.0101610838404336
Energy: 1.1029118857416518
Energy: 1.1982620943237983
Energy: 1.0476634363377861
Energy: 1.07637147115614
Energy: 1.2000446492397427
Energy: 1.0475139658739645
Energy: 1.274638711317396
Energy: 1.1546300820346815
Energy: 1.0428745050600845
Energy: 1.2766159476393228
Energy: 1.0479153792906801
Energy: 1.0453023591708568
Energy: 1.2016229680176695
Energy: 1.0104604296422728
Energy: 1.0983011521682249
Energy: 1.20336072848809
Energy: 1.153098017147825
Energy: 1.1976811482767937
Energy: 1.0457381549641847
Energy: 1.1980537193526941
Energy: 1.048043257845259
Energy: 1.0462582948718626
Energy: 1.0773951671851876
Energy: 1.0158864069335194
Energy: 1.1215323572416969
Energy: 1.0711520079231776
Energy: 1.0489292905172247
Energy: 1.0998908614763327
Energy: 1.070496435003303
Energy: 1.0475688381930521
Energy: 1.0449836778380888
Energy: 1.0999309584349666
Energy: 1.0419045971493677
Energy: 1.0452613790448873
Energy: 1.11090893635742
Energy: 1.047238417300276
Energy: 1.0479530963158565
Energy: 1.1040836269955467
Energy: 1.04669431873285
Energy: 1.0458262797147369
Energy: 1.103415163189472
Energy: 1.0465070101808889
Energy: 1.2339036526791254
Energy: 1.1633325974981976
Energy: 1.1644902253756806
Energy: 1.2226411466174
Energy: 1.0482144974241552
Energy: 1.1049047634527593
Energy: 1.1364923382567553
Energy: 1.0538195711573366
Energy: 1.0466440182902979
Energy: 1.131305874583647
Energy: 1.0475431203854473
Energy: 1.0497635626174004
Energy: 1.1144061171988509
Energy: 1.046815592573972
Energy: 1.0159031739861732
Energy: 1.0492907226842652
Energy: 0.9855989524120866
Energy: 1.1049590793039505
Energy: 1.225139293271513
Energy: 1.1033877211252778
Energy: 1.1058939295690748
Energy: 1.2261809142355593
Energy: 0.9848129277859732
Energy: 1.1036380953248666
Energy: 1.212548834286428
Energy: 1.050429667375985
Energy: 1.0779778175365509
Energy: 1.0788832340336219
Energy: 1.0499994055208943
Energy: 1.0471138170103735
Energy: 1.1263355458388984
Energy: 1.0478379955284227
Energy: 0.9845579001398905
Energy: 0.9832327519057078
Energy: 1.0481394659463152
Energy: 0.9845333816075167

minimum gb energy = 0.9832327519057078 eV
minimum distance =  2.34141541331735 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.829971920066898
Energy: 1.6197555759772388
Energy: 1.3542651519412146
Energy: 1.364408403942928
Energy: 1.5057800034029463
Energy: 1.3636371821345359
Energy: 1.370471346425044
Energy: 1.1737111054457174
Energy: 1.174657986640624
Energy: 1.2675965496436887
Energy: 1.174595507647807
Energy: 1.175023970873559
Energy: 1.4387692779556283
Energy: 1.1927572378031306
Energy: 1.2311917779239752
Energy: 1.4401166704990829
Energy: 1.1924004279341096
Energy: 1.235519002981624
Energy: 1.2882524293526105
Energy: 1.140370940801203
Energy: 1.1945085496594647
Energy: 1.2875496843988157
Energy: 1.1764623705668995
Energy: 1.202041730438568
Energy: 1.2895947455254009
Energy: 1.1753272437349171
Energy: 1.176058770597902
Energy: 1.2898228297884384
Energy: 1.1754725902634995
Energy: 1.1923176054489337
Energy: 1.2972458717118174
Energy: 1.188422146305585
Energy: 1.2005523788319048
Energy: 1.1760422576002647
Energy: 1.18832928572476
Energy: 1.176267050657744
Energy: 1.188370553456338
Energy: 1.2483877739119371
Energy: 1.2112298563767585
Energy: 1.1882948507633888
Energy: 1.1492698306009104
Energy: 1.1891497716394908
Energy: 1.1975402858202964
Energy: 1.2470779964295349
Energy: 1.2174080152397166
Energy: 1.1745295351769758
Energy: 1.2901119513359023
Energy: 1.1918006800965566
Energy: 1.1995430071353068
Energy: 1.2883448214397193
Energy: 1.2878171735058535
Energy: 1.1681503960109527
Energy: 1.2890920167304856
Energy: 1.1488066682707583
Energy: 1.163092306870236
Energy: 1.2874634731128678
Energy: 1.2850680698649368
Energy: 1.1862725881784644
Energy: 1.35485620459167
Energy: 1.147311262322266
Energy: 1.1971368290313165
Energy: 1.2194682759162838
Energy: 1.1921910147534094
Energy: 1.1754347396645533
Energy: 1.2182235776009427
Energy: 1.175176827500213
Energy: 1.3367412547011632
Energy: 1.1848895635113978
Energy: 1.2573237346419275
Energy: 1.3372585911365462
Energy: 1.2288162067803132
Energy: 1.316989677479537
Energy: 1.1735146392987623
Energy: 1.2899026052938156
Energy: 1.2923245043562503
Energy: 1.173614875910317
Energy: 1.291330766927049
Energy: 1.1753962464534065
Energy: 1.2294655711738107
Energy: 1.408868302841973
Energy: 1.2797037230713562
Energy: 1.1986238028297234
Energy: 1.43823391086005
Energy: 1.2478534791041485
Energy: 1.1455057161335258
Energy: 1.285267259371341
Energy: 1.2662759250581757
Energy: 1.1461656351807175
Energy: 1.2883963101734752
Energy: 1.1435597612453992
Energy: 1.144523888192187
Energy: 1.2294590559482579
Energy: 1.1443383238698621
Energy: 1.1460753621988713
Energy: 1.2587541844356867
Energy: 1.1431566382348524
Energy: 1.1456951870842251
Energy: 1.2259305222375008
Energy: 1.143399225457233
Energy: 1.145602866423708
Energy: 1.2524871222640905
Energy: 1.2406449398537576
Energy: 1.3760069295253698
Energy: 1.2967170535924009
Energy: 1.2357864522786037
Energy: 1.2278366888556915
Energy: 1.295994271086556
Energy: 1.2280674297160756
Energy: 1.222397887316864
Energy: 1.2229121427947978
Energy: 1.2199727150710011
Energy: 1.2224869794501605
Energy: 1.2263955461339044
Energy: 1.2247785905914537
Energy: 1.2537442325379442
Energy: 1.1437569311811997
Energy: 1.1453397044721045
Energy: 1.255340556886242
Energy: 1.1434621290935885
Energy: 1.2349928492131508
Energy: 1.305205492130678
Energy: 1.1444283676647675
Energy: 1.2291010228388328
Energy: 1.2372706091991459
Energy: 1.2048337079147706
Energy: 1.2325970828716706
Energy: 1.193791305790494
Energy: 1.2174364667826705
Energy: 1.2176478221460754
Energy: 1.1712263720691551
Energy: 1.2291327196980115
Energy: 1.2326816160836045
Energy: 1.2327446441261471
Energy: 1.254194771051397
Energy: 1.3062514689481592
Energy: 1.1396264455018958
Energy: 1.2549490886596812
Energy: 1.1403316897627693
Energy: 1.3081187070692353
Energy: 1.2225629461583953
Energy: 1.2385434657200722
Energy: 1.2262423187375382
Energy: 1.2227991632717674
Energy: 1.2231337464436103
Energy: 1.2960587324122979
Energy: 1.229352890410341
Energy: 1.217734223683282
Energy: 1.2967123932350442
Energy: 1.1881404326437435
Energy: 1.2472944127362124
Energy: 1.3383476007917108
Energy: 1.1776106245851985
Energy: 1.2409626054175962
Energy: 1.2379492272360546
Energy: 1.1455303831899952
Energy: 1.2565789875155702
Energy: 1.3221076908208216
Energy: 1.1434121294184127
Energy: 1.1431951920128138
Energy: 1.3045570301159835
Energy: 1.147125352553746
Energy: 1.143239956491742
Energy: 1.325856015998446
Energy: 1.1827414259631455
Energy: 1.143202339886563
Energy: 1.2874810756719188
Energy: 1.1457616211401982
Energy: 1.3118407556963494
Energy: 1.4406508148469186
Energy: 1.2233717620236653
Energy: 1.2244052062347814
Energy: 1.4427193419642237
Energy: 1.224224669212349
Energy: 1.2234216427463203
Energy: 1.4474810996266756
Energy: 1.1742335778097681
Energy: 1.1756839130620853
Energy: 1.2841823627074638
Energy: 1.1739645124522635
Energy: 1.2856079762956287
Energy: 1.209022035548399
Energy: 1.1762795124540946
Energy: 1.2446838891961962
Energy: 1.1436454732233003
Energy: 1.1767574225396369
Energy: 1.2454770790079985

minimum gb energy = 1.1396264455018958 eV
minimum distance =  2.28608275859589 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.640569374671274
Energy: 1.3664339745884782
Energy: 1.358256945673186
Energy: 1.3593090837601705
Energy: 2.1083064723530853
Energy: 1.3591060559678307
Energy: 1.1042893299751573
Energy: 1.1456940473663135
Energy: 1.1459740672239305
Energy: 1.1753100216553325
Energy: 1.1752715002874932
Energy: 1.143858306861375
Energy: 1.2597651788049868
Energy: 1.298544216035054
Energy: 1.1644093501260733
Energy: 1.2474936047467045
Energy: 1.1654437214782316
Energy: 1.1438220792351812
Energy: 1.234038969861486
Energy: 1.1442430077144103
Energy: 1.144536209717971
Energy: 1.1738540909789317
Energy: 1.1639591003948488
Energy: 1.1446969514256182
Energy: 1.205552623994398
Energy: 1.1466763479996287
Energy: 1.1448647515124937
Energy: 1.1754997296165892
Energy: 1.1728438215612584
Energy: 1.143518454159969
Energy: 1.1752179664994453
Energy: 1.2494541862154853
Energy: 1.2504729834521608
Energy: 1.174232582869472
Energy: 1.249161587853703
Energy: 1.2447095588518913
Energy: 1.2500816168403996
Energy: 1.2216819124417748
Energy: 1.1248311909367736
Energy: 1.2517832322918392
Energy: 1.2170491739978029
Energy: 1.2512973248321606
Energy: 1.294238426461409
Energy: 1.1883901070222995
Energy: 1.144108014094687
Energy: 1.1761562945461335
Energy: 1.2064482481993217
Energy: 1.144787160135119
Energy: 1.1044419839878452
Energy: 1.2408167248833608
Energy: 1.3677108654498416
Energy: 1.1021700913531498
Energy: 1.2332931812888142
Energy: 1.1039182428319279
Energy: 1.1039578107296022
Energy: 1.2420903125265428
Energy: 1.3672606708233186
Energy: 1.1022211743698447
Energy: 1.2468747543418508
Energy: 1.1040537730095215
Energy: 1.2941255704363097
Energy: 1.1449189825538704
Energy: 1.14468750897864
Energy: 1.1763718523370528
Energy: 1.1734499149110946
Energy: 1.1452182483186941
Energy: 1.6233374187843377
Energy: 1.2988741201083709
Energy: 1.2377250688331958
Energy: 1.624252368710882
Energy: 1.2997620999158535
Energy: 1.618768280796543
Energy: 1.1747435160886737
Energy: 1.1439573498136348
Energy: 1.145679518239745
Energy: 1.1747494120025204
Energy: 1.1749088293541667
Energy: 1.143307473184382
Energy: 1.4491318646002884
Energy: 1.2484505385314129
Energy: 1.2335876867532336
Energy: 1.1743244114774658
Energy: 1.2487694724808631
Energy: 1.2343076929337005
Energy: 1.2482787264753157
Energy: 1.2225853429012916
Energy: 1.1438242252185173
Energy: 1.24778740082433
Energy: 1.2196155477190957
Energy: 1.1431657734046616
Energy: 1.2610919755066876
Energy: 1.222299940459565
Energy: 1.103123077946651
Energy: 1.2628633286473923
Energy: 1.219669519685116
Energy: 1.1427276885326414
Energy: 1.1046953028167121
Energy: 1.1749743184348682
Energy: 1.1466210945044835
Energy: 1.103325430521917
Energy: 1.1745349104686515
Energy: 1.2032681412264021

minimum gb energy = 1.1021700913531498 eV
minimum distance =  2.33551300630401 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.9119774739250022
Energy: 1.6528201976070134
Energy: 1.3199367026808293
Energy: 1.324212546208232
Energy: 1.507702408297659
Energy: 1.320124986547297
Energy: 1.3563889343417201
Energy: 1.269746324722568
Energy: 1.2443350543297078
Energy: 1.2508140786764945
Energy: 1.3029255275061076
Energy: 1.251431994398053
Energy: 1.3063621845639108
Energy: 1.2559686963577736
Energy: 1.23646078969191
Energy: 1.307221051352546
Energy: 1.246708352509124
Energy: 1.285913839899576
Energy: 1.247352895793269
Energy: 1.249943884297599
Energy: 1.2535779397282711
Energy: 1.2780082005483926
Energy: 1.2440691897521066
Energy: 1.2665152518748581
Energy: 1.3089582462889209
Energy: 1.2268177210201001
Energy: 1.2420822148229473
Energy: 1.2405605774075457
Energy: 1.2609280097490623
Energy: 1.2463834537335556
Energy: 1.2637371560928143
Energy: 1.2397386589293125
Energy: 1.2355025979152467
Energy: 1.2654857295968358
Energy: 1.2441123320731027
Energy: 1.2349607176019382
Energy: 1.2677683142112472
Energy: 1.2361499659826367
Energy: 1.2678291680210347
Energy: 1.2686192693742502
Energy: 1.240876169590663
Energy: 1.2421044351043264
Energy: 1.3204169536147343
Energy: 1.2332660012381582
Energy: 1.2423180186580425
Energy: 1.2425573123731233
Energy: 1.2337470781202347
Energy: 1.2440365407360219
Energy: 1.4370869347568913
Energy: 1.2920532585808504
Energy: 1.2307033057756949
Energy: 1.2372236136715644
Energy: 1.3088045020670664
Energy: 1.2815291992016713
Energy: 1.2849773532840056
Energy: 1.245178324051227
Energy: 1.2440910222187902
Energy: 1.248103261445405
Energy: 1.2420958100518338
Energy: 1.2491708005022597
Energy: 1.2695920038966781
Energy: 1.2431234693007116
Energy: 1.242721322612343
Energy: 1.2420692362973056
Energy: 1.2446323036815061
Energy: 1.2554710544305947
Energy: 1.28930590813932
Energy: 1.2505254153581717
Energy: 1.2540132367971892
Energy: 1.259672595099143
Energy: 1.2513367184162887
Energy: 1.2570376396428569
Energy: 1.5100564019571516
Energy: 1.2836103221567172
Energy: 1.2801498994885245
Energy: 1.2330137598073476
Energy: 1.2795856997812196
Energy: 1.2331346765315307
Energy: 1.2902372764279813
Energy: 1.2453649745877433
Energy: 1.2617509322196634
Energy: 1.2857939511011822
Energy: 1.2273992440188046
Energy: 1.2684685944337573
Energy: 1.279418585153645
Energy: 1.2406834532698146
Energy: 1.2553362730370132
Energy: 1.2678796285506375
Energy: 1.241503589885045
Energy: 1.2471416122943346
Energy: 1.2662091324125095
Energy: 1.235360215336101
Energy: 1.253632484904345
Energy: 1.2666950275244693
Energy: 1.2416187798720815
Energy: 1.3451892945737138
Energy: 1.294352328483137
Energy: 1.2570225950662697
Energy: 1.265657127308729
Energy: 1.295010504627116
Energy: 1.2554128326644785
Energy: 1.2591405266451319
Energy: 1.4164387811405372
Energy: 1.223189845633588
Energy: 1.223532126786702
Energy: 1.3513781109769851
Energy: 1.3260862207702695
Energy: 1.2549975345602085
Energy: 1.2659665121588202
Energy: 1.2502201908762833
Energy: 1.254057970087839
Energy: 1.2664398425092827
Energy: 1.2609944075548585
Energy: 1.253015691264546
Energy: 1.2591932840125868
Energy: 1.2500607230735163
Energy: 1.2552076557957532
Energy: 1.260166799359233
Energy: 1.2500059144116287
Energy: 1.2543092633744133
Energy: 1.2547317078285696
Energy: 1.248736071483665
Energy: 1.2239897143911955
Energy: 1.2333493938465452
Energy: 1.2594537122202984
Energy: 1.2562912853724781

minimum gb energy = 1.223189845633588 eV
minimum distance =  2.29784344851999 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.3504537171880127
Energy: 1.279970517955218
Energy: 1.2790367381178396
Energy: 1.311535806597976
Energy: 2.0025318227376427
Energy: 1.2812501163715548
Energy: 1.224873281672281
Energy: 1.2591633323514275
Energy: 1.2393310133114848
Energy: 1.30724963279445
Energy: 1.2741871585270301
Energy: 1.21673830716278
Energy: 1.273315973580007
Energy: 1.2180481218387256
Energy: 1.2346948764267176
Energy: 1.274041444996682
Energy: 1.2377276852044559
Energy: 1.221101836605762
Energy: 1.270955884452794
Energy: 1.2228699404119652
Energy: 1.2192856039748552
Energy: 1.272188210251848
Energy: 1.2201543444779592
Energy: 1.22110216386626
Energy: 1.2713990811658917
Energy: 1.2226768056343775
Energy: 1.2225491559964181
Energy: 1.2719089169064082
Energy: 1.254318537913951
Energy: 1.2238038046093833
Energy: 1.2897633701664661
Energy: 1.2491300434039918
Energy: 1.217392043011349
Energy: 1.2906421143103108
Energy: 1.2579228476034046
Energy: 1.217217166689901
Energy: 1.250389199947044
Energy: 1.1317973881529098
Energy: 1.1362933183002397
Energy: 1.2511287688354493
Energy: 1.1812012404258763
Energy: 1.1333865945876127
Energy: 1.2431833316358083
Energy: 1.1839909452381279
Energy: 1.2151505560231157
Energy: 1.2440468046600148
Energy: 1.185719708253057
Energy: 1.215119812535679
Energy: 1.3769843221420883
Energy: 1.2374372462940928
Energy: 1.2364056277239024
Energy: 1.2215699025059328
Energy: 1.2554167429617185
Energy: 1.2226245424795648
Energy: 1.382917827778601
Energy: 1.2236803141492218
Energy: 1.220271548005688
Energy: 1.2373392144755868
Energy: 1.250009881923343
Energy: 1.219285855642884
Energy: 1.2451068379373684
Energy: 1.2167306812812566
Energy: 1.2163937437053325
Energy: 1.2456578369312583
Energy: 1.2450654036608588
Energy: 1.2151002422475303
Energy: 1.2890424335143738
Energy: 1.2394275602275058
Energy: 1.2388293203100094
Energy: 1.2907069081914042
Energy: 1.2350882417639906
Energy: 1.2548061018679242
Energy: 1.1774364682154972
Energy: 1.2724898761503172
Energy: 1.132080729204995
Energy: 1.179060132608388
Energy: 1.2760013330856679
Energy: 1.1327600605910706
Energy: 1.1776640708750907
Energy: 1.261121037247173
Energy: 1.2631538571201135
Energy: 1.1783283632334123
Energy: 1.2682804480242211
Energy: 1.132255195056925
Energy: 1.3090600012683642
Energy: 1.2403964763326727
Energy: 1.2410495227805136
Energy: 1.3099261766846593
Energy: 1.2400684459424305
Energy: 1.241967867326574
Energy: 1.2898990675165674
Energy: 1.2458339048444411
Energy: 1.2457493775092499
Energy: 1.2473480314286864
Energy: 1.2459242792449758
Energy: 1.2472081973189186
Energy: 1.262649060330223
Energy: 1.262019168698228
Energy: 1.2652412318998536
Energy: 1.2627266242507675
Energy: 1.261274630477821
Energy: 1.2789568270111207
Energy: 1.2869997180129495
Energy: 1.233880848848693
Energy: 1.2181695275048674
Energy: 1.2460005267368843
Energy: 1.2344059947840749
Energy: 1.2185850017912552
Energy: 1.2431827426878177
Energy: 1.1323203864660214
Energy: 1.1328241906622336
Energy: 1.2440941439782889
Energy: 1.1340755640233315
Energy: 1.1319674171788536
Energy: 1.2524294607737612
Energy: 1.1325249383453093
Energy: 1.1327799620399794
Energy: 1.2526177844089528
Energy: 1.1339850020496833
Energy: 1.131952268281103
Energy: 1.3619049016696483
Energy: 1.233478204766023
Energy: 1.233897519688345
Energy: 1.219763909606493
Energy: 1.2341717547762787
Energy: 1.2187612018100775
Energy: 1.2371393928884087
Energy: 1.278226949246599
Energy: 1.345599682942327
Energy: 1.2332481422324528
Energy: 1.3849892095981542
Energy: 1.3485803533083625
Energy: 1.3608689942900953
Energy: 1.216737380607757
Energy: 1.2163344060236283
Energy: 1.2686319183260149
Energy: 1.2331550961408948
Energy: 1.2164255041380323
Energy: 1.2636703609324937
Energy: 1.2216028109482915
Energy: 1.22256983882487
Energy: 1.3110860666573352
Energy: 1.2213463560157434
Energy: 1.2241134881778932
Energy: 1.3784674018442342
Energy: 1.2949864539971772
Energy: 1.27759498919661
Energy: 1.2889618216422516
Energy: 1.2986928515069243
Energy: 1.3064179858309222

minimum gb energy = 1.1317973881529098 eV
minimum distance =  2.30658292412053 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.274352547438323
Energy: 1.190191386703454
Energy: 1.209442018865895
Energy: 1.2337762636946084
Energy: 1.2832890256075526
Energy: 1.2070198783049275
Energy: 1.35308036463317
Energy: 1.2107896068788857
Energy: 1.2138548166499343
Energy: 1.2645207707663586
Energy: 1.238567536022351
Energy: 1.2137564109992338
Energy: 1.2627545601097296
Energy: 1.2246131232357325
Energy: 1.211929958834028
Energy: 1.2507199912774205
Energy: 1.3090928519881295
Energy: 1.212205252225214
Energy: 1.267676118636444
Energy: 1.2613051058347688
Energy: 1.2132141422793052
Energy: 1.239783081243965
Energy: 1.2327290453439932
Energy: 1.2136385268542238
Energy: 1.2445778583932503
Energy: 1.232883245739564
Energy: 1.2074491985989522
Energy: 1.2450828618701484
Energy: 1.3314267629929444
Energy: 1.2198334211837556
Energy: 1.316487258399021
Energy: 1.2126927785937387
Energy: 1.2125534521842787
Energy: 1.2403636964817462
Energy: 1.239178873211979
Energy: 1.2298568896405917
Energy: 1.315959828265032
Energy: 1.21125901703378
Energy: 1.2132600643513107
Energy: 1.285591061834238
Energy: 1.2111561899496661
Energy: 1.2116475777167122
Energy: 1.2576199183934638
Energy: 1.2107487108689452
Energy: 1.212409975956938
Energy: 1.253611415712229
Energy: 1.2249113040653183
Energy: 1.2124192170401127
Energy: 1.2249182304765642
Energy: 1.211975791240851
Energy: 1.213157402139722
Energy: 1.2252647099681864
Energy: 1.249789745961921
Energy: 1.2124036596165535
Energy: 1.2253714570680465
Energy: 1.214743522459771
Energy: 1.2146494949374653
Energy: 1.2259153033872152
Energy: 1.2425471110091393
Energy: 1.213496184333617
Energy: 1.331654754033636
Energy: 1.3883913486202044
Energy: 1.3884414944719519
Energy: 1.3327300740139159
Energy: 1.3879740281442672
Energy: 1.4048952004831798
Energy: 1.2380404008970445
Energy: 1.2104665973960778
Energy: 1.2109500832687254
Energy: 1.2378609026038803
Energy: 1.2175032766832647
Energy: 1.1950035437711348
Energy: 1.3863085531829102
Energy: 1.2427764202857952
Energy: 1.2614751597973803
Energy: 1.3219450454208248
Energy: 1.2351908242728393
Energy: 1.2106611847226512
Energy: 1.267517549010002
Energy: 1.2371558331028971
Energy: 1.2136781454959071
Energy: 1.2088144708921995
Energy: 1.2404967586664946
Energy: 1.2143069864595224
Energy: 1.2368769066307783
Energy: 1.1982290099533364
Energy: 1.1945725098837607
Energy: 1.2372641190486358
Energy: 1.1989193828050988
Energy: 1.1954747825795122
Energy: 1.23732433553099
Energy: 1.196494874272648
Energy: 1.1963113272695365
Energy: 1.2378773171252742
Energy: 1.2063825375195778
Energy: 1.1968329326010296
Energy: 1.5078510506258211
Energy: 1.2142849549261383
Energy: 1.2247830989001058
Energy: 1.4001895998867826
Energy: 1.2385833585681878
Energy: 1.225681819230881
Energy: 1.2482498973028209
Energy: 1.1941162460746981
Energy: 1.1975507075938914
Energy: 1.2065674887172018
Energy: 1.2288237533135649
Energy: 1.1971453184083258
Energy: 1.29562353696992
Energy: 1.2094980080925237
Energy: 1.2094319082442184
Energy: 1.2969901492907656
Energy: 1.2112052564504898
Energy: 1.2384310601355417
Energy: 1.2753871158904333
Energy: 1.2096281750751865
Energy: 1.2101163046882224
Energy: 1.2770098057324828
Energy: 1.2108359280469916
Energy: 1.2441393559582483
Energy: 1.1979388923230765
Energy: 1.1958719724965923
Energy: 1.1981292573325908
Energy: 1.1980042185729218
Energy: 1.218714595813821
Energy: 1.1973292977860261
Energy: 1.198892055869363
Energy: 1.1948833117483697
Energy: 1.194792146658445
Energy: 1.1992167502965627
Energy: 1.2006725882220313
Energy: 1.1943664102885254
Energy: 1.268383766292331
Energy: 1.2250257811989285
Energy: 1.226719766139464
Energy: 1.2693153606564729
Energy: 1.2218699807402364
Energy: 1.1979620920622163
Energy: 1.3020576689703793
Energy: 1.2229153509504134
Energy: 1.2324427412833816
Energy: 1.3017817578885746
Energy: 1.2224409112474854
Energy: 1.1900269072600287
Energy: 1.2386076610948649
Energy: 1.2061080707842264
Energy: 1.1949423517798066
Energy: 1.2170334792790607
Energy: 1.234956862302348
Energy: 1.194525735566679
Energy: 1.3826925774573753
Energy: 1.2097416771037162
Energy: 1.2127560197169087
Energy: 1.3317710755335692
Energy: 1.25405644713999
Energy: 1.212224745269938
Energy: 1.262905748984791
Energy: 1.2145782966014531
Energy: 1.2144849788564223
Energy: 1.252868131616624
Energy: 1.2256953386875955
Energy: 1.2141611554412082
Energy: 1.262506528095656
Energy: 1.2129350669316306
Energy: 1.2129842774745532
Energy: 1.2396528990431845
Energy: 1.2186919036894222
Energy: 1.2138140138541713
Energy: 1.2457740988715063
Energy: 1.2558317401917072
Energy: 1.3036261665752074
Energy: 1.246177493004306
Energy: 1.2596365009123014
Energy: 1.2698616524283166

minimum gb energy = 1.1900269072600287 eV
minimum distance =  2.29710454519843 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.6450247265081543
Energy: 1.2108992969353845
Energy: 1.2113132177990134
Energy: 1.5038509019898674
Energy: 1.2916416429098905
Energy: 1.5073931139468992
Energy: 1.2703331004596512
Energy: 1.197737254181027
Energy: 1.1875660566304826
Energy: 1.2405611416608813
Energy: 1.1660183301700553
Energy: 1.1867323604656546
Energy: 1.25217116379883
Energy: 1.2000743249442622
Energy: 1.2013105092926808
Energy: 1.2293347504936378
Energy: 1.1981254008681959
Energy: 1.2025158640587004
Energy: 1.2250097730391414
Energy: 1.2029751220114888
Energy: 1.1994531952302856
Energy: 1.1864476376109176
Energy: 1.2027519887204408
Energy: 1.1994238144384977
Energy: 1.1903598073315165
Energy: 1.3552277869917184
Energy: 1.2044291071296265
Energy: 1.1926246671899072
Energy: 1.360758002433765
Energy: 1.2020871489448444
Energy: 1.1838210741625723
Energy: 1.2141929625251757
Energy: 1.2022828247132384
Energy: 1.181807247101968
Energy: 1.260566590401191
Energy: 1.1982539310519145
Energy: 1.2422246926320981
Energy: 1.3604337972754703
Energy: 1.3569256363622901
Energy: 1.2129316105766998
Energy: 1.3560592740527682
Energy: 1.1944228174828204
Energy: 1.229964937972987
Energy: 1.1890894624917971
Energy: 1.1914256149609619
Energy: 1.2132590319086258
Energy: 1.1846236667430063
Energy: 1.1864357026715897
Energy: 1.1703378979300316
Energy: 1.1795981890364922
Energy: 1.187277875679736
Energy: 1.1681155195792596
Energy: 1.2231758511141895
Energy: 1.186752428930275
Energy: 1.1677816475388698
Energy: 1.1939176393171114
Energy: 1.1930004256130178
Energy: 1.168300273244082
Energy: 1.2025588465971104
Energy: 1.205773842406838
Energy: 1.3712586610164217
Energy: 1.177599844924814
Energy: 1.5170761765274228
Energy: 1.3720923458634309
Energy: 1.1774336529468963
Energy: 1.51150249683221
Energy: 1.2654766303504834
Energy: 1.2056168040691422
Energy: 1.2041077021637172
Energy: 1.2657448964622615
Energy: 1.1909315303494536
Energy: 1.191726936938502
Energy: 1.4266850828106914
Energy: 1.1786621911347055
Energy: 1.1806893805404244
Energy: 1.361541195912691
Energy: 1.2173779289198434
Energy: 1.1881162800867846
Energy: 1.1782516881735339
Energy: 1.2007259713681198
Energy: 1.2005654451614252
Energy: 1.1645630937388305
Energy: 1.17742066182003
Energy: 1.1949435351931532
Energy: 1.2511023724567523
Energy: 1.1803993023041384
Energy: 1.1892324532980814
Energy: 1.2282373280289705
Energy: 1.1773362223187014
Energy: 1.1925891826284332
Energy: 1.294837334067567
Energy: 1.1693291329303908
Energy: 1.1995131917698951
Energy: 1.2169195495991394
Energy: 1.2086542650625924
Energy: 1.200377717025272
Energy: 1.6572837693238822
Energy: 1.3084956041571825
Energy: 1.2085261996943124
Energy: 1.1782496780576315
Energy: 1.2288891019756838
Energy: 1.495931111332048
Energy: 1.2696175664633633
Energy: 1.180364305881461
Energy: 1.1872528908507878
Energy: 1.2718196271894702
Energy: 1.2462068358731109
Energy: 1.2053472418406421
Energy: 1.2522353576985408
Energy: 1.1748764425716283
Energy: 1.187401744119422
Energy: 1.2298930437430537
Energy: 1.1703081233559078
Energy: 1.1873168329765356
Energy: 1.2472942582391078
Energy: 1.174607250177646
Energy: 1.1935852041219315
Energy: 1.2539326803573596
Energy: 1.1689287152492776
Energy: 1.1936972884084163
Energy: 1.1936032594734873
Energy: 1.3560641277077197
Energy: 1.2015953682735006
Energy: 1.1936736883806138
Energy: 1.3570752919639892
Energy: 1.2049236127150915
Energy: 1.1991162310784627
Energy: 1.187014068572441
Energy: 1.1870726022456277
Energy: 1.1993736574057055
Energy: 1.198196169043187
Energy: 1.1866235390933313
Energy: 1.1840419048781987
Energy: 1.1972981206538085
Energy: 1.1964409414935055
Energy: 1.1850770061346134
Energy: 1.1901813071622405
Energy: 1.1970280946307268
Energy: 1.239903465916725
Energy: 1.1984994523374437
Energy: 1.1955034980301205
Energy: 1.2266604489470647
Energy: 1.1740025112247874
Energy: 1.1799154358024564
Energy: 1.1672618416508669
Energy: 1.1800720949845416
Energy: 1.1873271108551302
Energy: 1.1675165069473132
Energy: 1.1978626071943492
Energy: 1.18741503217033
Energy: 1.1705467420669542
Energy: 1.1927371202844228
Energy: 1.1921117458342487
Energy: 1.1698852464785174
Energy: 1.20204309528703
Energy: 1.1926918390203272
Energy: 1.3877451466557955
Energy: 1.1406743146549214
Energy: 1.1781065366591965
Energy: 1.3658457011217577
Energy: 1.138968555451259
Energy: 1.1779349168653916
Energy: 1.2569401708177041
Energy: 1.170132927337979
Energy: 1.1695828986600658
Energy: 1.2524966175295182
Energy: 1.157165894715651
Energy: 1.1967710597423418
Energy: 1.1773410875019286
Energy: 1.1872857576455138
Energy: 1.1956102406257818
Energy: 1.1664466458038967
Energy: 1.232411686765586
Energy: 1.1984727465122933
Energy: 1.179397617626568
Energy: 1.179737000207952
Energy: 1.1878629279416488
Energy: 1.3551773193387329
Energy: 1.1789875049706964
Energy: 1.1946323994018873
Energy: 1.2522835404362793
Energy: 1.1825750688676833
Energy: 1.1975650418962536
Energy: 1.2536425224351997
Energy: 1.1829884685470102
Energy: 1.1965265189363188
Energy: 1.2511890767566165
Energy: 1.1553230587052206
Energy: 1.1995075292777906
Energy: 1.2163735751519362
Energy: 1.169151740572725
Energy: 1.1873705147435245
Energy: 1.1638147725199153
Energy: 1.2241234621531776
Energy: 1.214431716556869
Energy: 1.17437451017924
Energy: 1.2433634730294716
Energy: 1.2151579099069385

minimum gb energy = 1.138968555451259 eV
minimum distance =  2.29706721888808 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.020482217776494206
Energy: 0.022725093734127833
Energy: 0.021191895480773222
Energy: 0.023043349349618394
Energy: 0.9361196611632563
Energy: 0.02109497932342825
Energy: 0.021502311950372947
Energy: 0.1729252530590172
Energy: 0.17058088127325774
Energy: 0.1700175773612182
Energy: 0.171239937529087
Energy: 0.17011392851249657
Energy: 1.3896189482711443
Energy: 0.9400618803910642
Energy: 0.9372727448834977
Energy: 0.9332320469541002
Energy: 0.9379715922946463
Energy: 0.9365682572538013
Energy: 0.6203576367927531
Energy: 0.1729252530590172
Energy: 0.1705808812737255
Energy: 0.17001757736075043
Energy: 0.17123993753002253
Energy: 0.1701139285134321

minimum gb energy = 0.020482217776494206 eV
minimum distance =  2.4569441025962 Angstroms
sigma value = 1